data_2mph_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 2mph _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 38.5 t . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.667 0.27 . . . . 74.33 111.042 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.449 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 76.7 Cg_endo -77.75 137.35 15.98 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.564 2.176 . . . . 74.01 112.36 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -82.41 153.66 25.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 75.31 110.87 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.8 119.91 5.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.219 -0.446 . . . . 63.54 111.072 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.97 -34.22 15.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 65.24 110.988 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.452 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 1.4 m-90 -113.95 173.17 6.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.141 -0.482 . . . . 74.04 110.943 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.1 m -118.4 154.5 32.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.018 -0.537 . . . . 74.51 110.719 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 93.1 t -57.47 -35.52 50.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.939 0.4 . . . . 73.23 110.65 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -70.19 -28.51 65.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 72.34 111.068 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -82.18 -56.79 3.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.871 0.367 . . . . 74.31 111.098 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.6 mt -49.6 -64.59 0.76 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.2 -0.454 . . . . 72.41 111.23 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.04 -25.48 21.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.49 . . . . 73.43 111.182 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.7 173.95 0.08 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.957 0.408 . . . . 73.2 111.313 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -110.37 16.93 21.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.865 -0.607 . . . . 72.12 111.182 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -109.8 -20.83 12.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.544 -0.298 . . . . 75.15 111.218 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.452 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 10.4 tt -91.85 129.78 40.94 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.521 -0.309 . . . . 74.23 110.943 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.89 126.33 11.83 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.396 2.064 . . . . 72.45 112.309 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -24.11 67.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 73.4 111.178 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.0 mmtt -52.84 -39.25 62.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.359 -0.382 . . . . 74.14 111.374 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.39 -57.6 4.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.272 -0.422 . . . . 65.45 111.04 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.457 HD12 HG21 ' A' ' 25' ' ' ILE . 36.2 mt -44.8 -30.67 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.61 . . . . 74.24 111.479 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.1 mt -77.86 -37.33 23.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 74.12 111.008 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -75.37 -24.87 57.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.096 -0.502 . . . . 75.04 111.069 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.489 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 11.8 t80 -72.04 -44.98 62.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.971 0.415 . . . . 63.54 110.837 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.3 mt -68.93 -27.49 65.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 73.53 110.981 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -75.39 -26.57 58.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.271 -0.422 . . . . 74.32 111.127 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.401 ' OE2' ' CD2' ' A' ' 32' ' ' HIS . 0.6 OUTLIER -100.94 -7.2 23.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.413 -0.358 . . . . 71.41 111.317 179.953 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.489 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 10.4 m170 -118.88 -8.73 10.24 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.63 -0.259 . . . . 72.4 111.371 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -123.64 164.74 16.66 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.782 -0.723 . . . . 43.32 112.375 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.7 p -93.21 156.94 16.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.635 0.255 . . . . 74.25 110.535 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -48.18 -55.4 10.5 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.745 0.307 . . . . 74.14 111.086 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.7 m -50.47 -48.14 56.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.023 0.439 . . . . 74.34 110.786 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.471 ' CZ ' ' CD1' ' A' ' 66' ' ' LEU . 1.6 t80 -55.83 -48.66 75.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.842 -0.617 . . . . 75.21 110.44 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.409 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 13.2 mt -66.47 -42.85 86.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.007 -0.542 . . . . 75.52 110.798 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.438 ' CB ' HD22 ' A' ' 44' ' ' LEU . . . -47.39 -41.87 20.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.098 0.475 . . . . 65.31 110.969 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -49.37 -51.44 34.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.623 -0.717 . . . . 74.45 111.062 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -99.95 13.22 34.65 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.98 -0.555 . . . . 70.44 111.287 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt 55.91 41.81 29.54 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.86 0.362 . . . . 74.31 110.862 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 23.3 mt -92.51 -20.45 20.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.073 -0.512 . . . . 73.2 111.491 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.438 HD22 ' CB ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -80.19 157.72 26.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.122 0.487 . . . . 74.34 111.171 -179.741 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.72 -119.9 4.65 Favored Glycine 0 N--CA 1.451 -0.357 0 CA-C-N 115.608 -0.724 . . . . 63.0 112.417 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -116.36 115.14 25.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.72 0.295 . . . . 70.25 110.947 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mp -45.75 -57.22 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.248 -0.433 . . . . 73.12 111.365 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.3 mttt -46.71 -37.23 8.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.87 -0.604 . . . . 71.5 110.944 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -85.7 -26.24 26.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.97 -0.559 . . . . 74.2 111.019 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.6 t -81.21 -26.0 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.411 . . . . 74.14 111.371 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.63 -15.69 63.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.436 -0.347 . . . . 75.44 111.164 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.9 ttpp -95.12 -31.32 13.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.307 -0.406 . . . . 75.33 110.919 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.11 -33.63 17.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 71.12 111.142 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.68 127.25 38.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.264 -0.425 . . . . 70.24 111.163 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -83.49 175.89 9.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 73.55 110.663 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -58.12 9.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.88 0.372 . . . . 75.35 110.595 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.43 -27.81 69.55 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.035 -0.529 . . . . 72.31 110.594 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.1 -43.88 98.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.105 -0.498 . . . . 63.2 110.511 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 21.1 mt -71.59 -34.45 69.9 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.693 -0.685 . . . . 64.12 111.06 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.1 t -76.4 -41.9 35.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.017 0.437 . . . . 74.2 110.922 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.7 m -60.54 -34.26 73.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.892 -0.595 . . . . 73.2 110.654 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.414 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -81.02 -22.12 39.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 74.31 111.138 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -83.59 -22.84 32.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.295 -0.412 . . . . 72.41 111.079 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 41.9 m-20 -84.46 -54.24 4.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 71.42 111.49 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.414 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 3.1 p-80 -62.08 -32.9 73.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.073 -0.512 . . . . 64.11 111.288 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.471 ' CD1' ' CZ ' ' A' ' 37' ' ' PHE . 8.3 tt -47.69 -40.52 20.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.887 0.375 . . . . 74.43 111.201 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -78.14 -38.06 44.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.061 -0.518 . . . . 74.31 110.598 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.77 -38.45 86.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.992 -0.549 . . . . 61.15 110.823 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.1 p -87.85 -7.08 57.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 75.51 111.526 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 47.65 41.13 13.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.707 0.289 . . . . 74.44 111.556 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -107.34 46.04 0.96 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.91 0.386 . . . . 73.24 110.845 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.463 ' CD2' HD23 ' A' ' 66' ' ' LEU . 88.3 m-85 -60.58 179.07 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.014 -0.539 . . . . 74.4 110.741 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 41.2 tttm . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 74.41 110.798 179.907 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 19.8 mttt . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.81 0.338 . . . . 75.44 111.0 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.0 p90 -165.68 166.86 17.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 75.35 110.906 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' THR . . . . . 0.449 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 0.3 OUTLIER -134.03 127.66 32.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.479 . . . . 71.42 110.546 179.807 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.01 144.51 49.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.951 0.405 . . . . 74.33 111.231 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.3 m -143.16 115.34 8.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.004 -0.544 . . . . 73.32 110.71 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 24.2 t -74.61 106.27 4.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.292 -0.413 . . . . 74.33 111.331 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.0 mp -74.04 -63.06 1.3 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 72.45 110.758 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.6 108.07 16.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 75.13 110.878 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.78 140.79 54.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.222 -0.445 . . . . 75.35 110.98 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.505 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -112.37 -154.38 12.17 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.795 -0.717 . . . . 74.33 112.404 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -36.8 -51.9 0.9 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.956 0.408 . . . . 73.3 111.446 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.7 tttm 69.69 35.64 2.34 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.908 -0.587 . . . . 73.12 110.197 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.27 -44.76 0.09 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.702 -0.681 . . . . 73.22 110.724 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -89.08 89.44 7.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 72.31 110.843 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -97.61 154.72 37.83 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.479 . . . . 75.04 110.909 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.41 125.59 11.97 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.577 2.185 . . . . 65.33 112.356 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -99.75 153.22 19.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 75.01 110.914 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.55 116.9 5.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.245 -0.434 . . . . 75.55 110.856 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 107.42 -23.21 27.21 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.715 -0.755 . . . . 71.42 112.517 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.38 139.73 30.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.771 0.319 . . . . 74.25 110.732 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.512 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 16.9 m -70.84 174.32 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.035 0.445 . . . . 75.52 111.432 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.655 ' O ' ' HA ' ' A' ' 163' ' ' SER . 20.7 m -157.51 145.49 10.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.66 -0.7 . . . . 64.04 110.387 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.465 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.22 117.72 22.88 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.722 0.296 . . . . 75.42 110.683 179.815 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . 0.451 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 27.3 p -155.2 170.86 20.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.027 0.441 . . . . 72.31 111.191 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.425 ' CZ2' ' HG3' ' A' ' 161' ' ' PRO . 8.8 m95 -106.37 163.64 12.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.84 -0.618 . . . . 75.11 110.21 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.448 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 35.8 p90 -160.97 135.18 7.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.129 0.49 . . . . 71.41 111.751 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.41 110.7 14.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.612 -0.722 . . . . 74.53 110.137 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.581 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.61 144.27 17.07 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.565 -0.826 . . . . 73.11 113.468 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.72 130.26 12.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.681 0.277 . . . . 74.12 110.385 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 35.3 mt -60.93 -178.32 0.1 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.445 -0.343 . . . . 73.32 110.841 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -56.04 -41.48 75.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 74.23 110.746 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -83.56 -0.57 50.94 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.979 -0.555 . . . . 75.03 111.474 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 93.79 25.79 16.75 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.64 -0.791 . . . . 62.31 112.637 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.12 111.48 17.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.76 0.314 . . . . 72.21 110.874 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 34.9 t -65.59 120.91 13.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 75.4 111.17 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.427 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 35.2 p90 -112.13 -24.71 9.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 75.45 111.06 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . 0.414 ' HB2' ' CE1' ' A' ' 145' ' ' PHE . 28.9 m-20 -161.89 113.37 1.69 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.427 -0.351 . . . . 74.51 110.94 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 90.0 m -125.29 105.58 9.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 73.42 111.04 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . 0.448 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 19.7 t30 -88.73 -0.62 57.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 73.31 111.27 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.408 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 21.7 mm . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.757 0.313 . . . . 74.12 110.913 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.775 0.321 . . . . 75.43 111.094 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -146.38 112.53 4.37 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 73.11 110.844 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . 0.425 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 67.1 Cg_exo -51.01 154.02 7.97 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.422 2.081 . . . . 72.42 112.328 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.412 ' CD2' ' CD1' ' A' ' 164' ' ' PHE . 3.2 tt -78.35 122.37 25.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 65.01 110.522 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.655 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -100.42 121.35 41.4 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.94 0.4 . . . . 74.54 111.236 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . 0.426 ' CE1' ' CG2' ' A' ' 131' ' ' VAL . 10.1 p90 -150.1 141.74 23.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.98 -0.555 . . . . 74.31 110.731 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 72.6 mttt -77.33 136.63 38.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.083 0.468 . . . . 75.23 111.201 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.0 m -87.64 149.38 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.704 -0.68 . . . . 73.54 111.185 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.83 24.09 75.65 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.912 -0.661 . . . . 73.21 112.673 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 14.4 m -132.27 44.77 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.914 0.388 . . . . 72.1 111.043 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.7 36.39 4.67 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 121.188 -0.529 . . . . 72.52 113.215 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 3.0 mmtm -82.99 -47.11 12.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.941 0.401 . . . . 61.21 110.983 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . 0.419 HG12 ' CE3' ' A' ' 175' ' ' TRP . 0.6 OUTLIER -118.3 -179.65 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.963 -0.562 . . . . 75.2 110.992 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.508 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -58.82 159.54 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 75.33 111.23 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -68.25 -26.1 65.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 71.44 111.297 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -77.84 -37.06 30.75 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.669 -0.777 . . . . 74.24 112.198 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.508 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.4 t90 -77.3 -33.57 55.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.897 0.38 . . . . 73.33 111.17 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.96 -37.16 83.76 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.016 -0.538 . . . . 74.14 110.617 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -73.27 -30.07 63.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.016 -0.538 . . . . 71.3 110.731 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -83.4 -48.82 9.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.147 -0.479 . . . . 74.21 111.249 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.462 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 9.4 mt -63.47 -34.42 77.72 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.074 -0.512 . . . . 62.31 110.801 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 35.6 tp -55.71 -23.12 27.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 75.24 111.115 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 51.1 p -98.64 2.25 47.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.368 -0.378 . . . . 72.03 111.567 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.19 152.39 34.82 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.729 0.299 . . . . 71.51 110.737 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -115.43 161.99 17.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.31 -0.405 . . . . 64.2 111.259 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -60.05 122.51 14.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.94 -0.573 . . . . 75.11 110.461 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 66.72 60.41 6.19 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.556 -0.83 . . . . 54.52 112.373 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . 0.505 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 17.1 tt0 -141.58 148.28 39.03 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.306 -0.257 . . . . 74.34 110.306 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 9.9 ttpt -117.26 135.61 53.69 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.184 -0.302 . . . . 74.31 110.184 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.73 168.9 18.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.126 0.489 . . . . 75.44 111.809 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.72 101.11 4.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.597 -0.729 . . . . 75.44 109.711 179.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.449 ' HA ' ' O ' ' A' ' 112' ' ' THR . 0.3 OUTLIER -115.34 143.91 44.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.101 0.477 . . . . 74.23 112.06 -178.853 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -118.0 115.07 24.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.603 -0.726 . . . . 75.22 110.531 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.422 HD11 ' CZ ' ' A' ' 216' ' ' PHE . 3.3 mp -96.93 134.79 33.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 74.04 111.247 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -70.89 166.1 40.66 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.912 -0.586 . . . . 73.33 110.808 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.94 -14.42 44.44 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.579 2.186 . . . . 72.14 112.604 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -79.64 -25.71 41.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.68 0.276 . . . . 70.34 111.245 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . . . . . . . . . 12.8 m0 -117.1 37.08 3.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.452 -0.34 . . . . 75.22 111.277 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -145.97 -83.46 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.353 -0.385 . . . . 70.24 111.356 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.446 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 15.8 m-85 -109.43 -34.5 6.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.901 0.381 . . . . 75.34 110.875 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 118.18 170.02 14.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.85 -0.69 . . . . 72.1 112.577 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.89 -29.0 62.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.806 0.336 . . . . 65.11 110.926 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -66.67 -50.69 62.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.224 -0.444 . . . . 73.25 110.856 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 115.31 -162.66 12.4 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.87 -0.681 . . . . 54.11 112.468 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . 0.424 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 1.2 tm0? -137.0 77.65 42.78 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.891 0.377 . . . . 75.42 110.863 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.61 -23.23 24.91 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.625 2.216 . . . . 73.43 112.422 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.96 -41.89 79.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.298 -0.41 . . . . 74.01 111.046 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.96 30.4 6.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.088 -0.506 . . . . 73.12 111.126 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.32 35.67 25.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 73.02 110.918 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . 0.438 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 32.0 mt -98.53 111.74 60.78 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.454 . . . . 75.34 111.095 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.13 171.11 15.48 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.478 2.119 . . . . 72.11 112.373 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.56 142.12 69.93 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.586 2.19 . . . . 73.21 112.265 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 54.18 69.44 0.72 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.208 -0.451 . . . . 64.22 111.024 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -122.43 115.02 21.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 63.32 111.466 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -65.35 131.49 46.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.043 -0.526 . . . . 75.53 110.452 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.446 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 4.9 mt -113.58 109.41 18.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.896 0.379 . . . . 64.34 111.68 -179.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 2.8 m -109.59 140.1 43.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.546 . . . . 73.13 110.417 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.581 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 4.7 p90 -156.32 -179.29 8.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.013 0.435 . . . . 74.14 111.387 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -134.34 137.65 44.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.721 -0.672 . . . . 74.44 110.432 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.7 t -120.32 151.76 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.99 0.424 . . . . 75.44 111.997 -179.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -136.33 105.87 6.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.777 -0.647 . . . . 72.1 110.221 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . 0.451 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 1.0 OUTLIER -69.96 129.5 39.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.343 -0.39 . . . . 75.21 110.845 -179.755 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 33.7 t -108.24 -28.99 2.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.266 -0.424 . . . . 72.45 111.426 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . 0.402 ' O ' HD22 ' A' ' 220' ' ' LEU . 5.5 t70 -171.18 162.23 6.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.839 0.352 . . . . 60.14 111.024 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 46.5 mt -140.75 111.16 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 74.13 111.135 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 72.1 110.817 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.1 t . . . . . 0 CA--C 1.529 0.148 0 CA-C-O 120.611 0.243 . . . . 74.24 110.952 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.428 ' HD2' ' CE1' ' A' ' 72' ' ' PHE . 85.6 Cg_endo -80.46 145.46 16.67 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.632 2.221 . . . . 74.22 112.426 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -81.28 149.72 28.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.267 -0.424 . . . . 74.23 110.884 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.63 98.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 70.42 111.33 -179.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.58 -19.19 64.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.983 -0.553 . . . . 65.32 111.391 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.441 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 2.9 m-90 -136.99 173.89 11.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.96 0.409 . . . . 74.31 110.914 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -115.64 150.89 35.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.871 -0.604 . . . . 72.4 110.475 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 32.7 t -56.11 -32.01 32.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.929 0.395 . . . . 73.11 110.818 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -73.98 -26.29 60.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.959 -0.564 . . . . 73.44 111.21 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -82.26 -57.27 3.45 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.892 0.377 . . . . 73.0 111.095 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.5 mt -49.67 -63.46 1.1 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.153 -0.476 . . . . 64.55 111.158 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.7 mtt180 -54.34 -24.42 19.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.125 -0.489 . . . . 74.02 111.217 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.08 176.97 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.944 0.402 . . . . 75.02 111.115 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -110.35 16.69 21.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.941 -0.572 . . . . 73.01 111.13 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -108.34 -28.02 9.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.519 -0.31 . . . . 74.54 111.093 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.441 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 7.0 tt -85.9 113.11 49.8 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.334 -0.393 . . . . 71.24 110.967 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -56.39 123.96 15.11 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.401 2.067 . . . . 75.55 112.172 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -24.11 65.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 74.44 111.089 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.7 mmtp -53.7 -33.59 55.96 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.281 -0.418 . . . . 70.04 111.332 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -78.76 -51.87 9.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.966 0.413 . . . . 71.41 110.998 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.468 HG22 HD12 ' A' ' 25' ' ' ILE . 31.1 mt -46.82 -33.17 2.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.896 -0.593 . . . . 75.04 111.311 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 12.1 mt -74.95 -52.94 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.084 0.468 . . . . 75.15 111.015 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.01 -22.8 41.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.752 -0.658 . . . . 75.04 111.323 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -75.08 -49.37 19.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.966 0.413 . . . . 72.41 110.851 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 mt -65.5 -26.63 68.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.914 -0.585 . . . . 75.22 110.938 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -81.27 -27.03 35.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.295 -0.411 . . . . 70.24 111.038 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.426 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -97.09 -6.13 35.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.492 -0.322 . . . . 75.25 111.198 179.714 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.426 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 92.2 m-70 -128.4 -3.23 5.52 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.346 . . . . 73.13 111.484 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.65 157.21 15.58 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.711 -0.757 . . . . 74.41 112.289 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.4 p -92.66 149.89 21.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.624 0.25 . . . . 65.44 110.625 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -44.15 -49.77 8.9 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.405 -0.361 . . . . 74.12 111.49 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.6 p -55.03 -47.42 74.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.008 0.433 . . . . 65.33 110.506 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.492 ' CE2' ' CE1' ' A' ' 65' ' ' HIS . 4.1 t80 -58.13 -44.12 87.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.692 . . . . 72.41 110.703 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.442 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 3.1 mt -63.57 -49.19 74.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.256 -0.429 . . . . 71.31 110.895 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -49.2 -28.19 4.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.115 -0.493 . . . . 71.25 111.349 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -77.43 -33.1 54.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 71.43 111.218 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.431 ' NE2' ' CE1' ' A' ' 65' ' ' HIS . 6.3 m-70 -108.78 10.42 26.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.395 -0.366 . . . . 74.34 111.58 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' A' ' 38' ' ' LEU . 12.8 mttp 60.21 31.86 20.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.779 0.323 . . . . 74.1 110.992 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.415 ' CB ' ' CD2' ' A' ' 38' ' ' LEU . 64.5 mt -84.56 -21.12 30.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 73.31 111.054 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.442 ' N ' ' HB3' ' A' ' 38' ' ' LEU . 61.7 mt -48.75 170.34 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.944 0.402 . . . . 73.04 111.104 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.27 -163.39 34.26 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.784 -0.722 . . . . 62.41 112.78 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -102.85 148.77 25.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.88 0.372 . . . . 74.12 111.016 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.1 mp -45.27 -43.29 3.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.015 -0.539 . . . . 72.33 111.498 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -56.44 -42.33 77.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.877 -0.601 . . . . 73.33 111.092 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -85.74 -28.17 24.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.084 -0.507 . . . . 74.53 111.336 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.2 t -77.41 -26.42 15.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 75.21 111.478 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.55 -25.24 65.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.383 -0.371 . . . . 61.22 111.311 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.3 pttt -95.22 -30.95 13.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.311 -0.404 . . . . 74.35 111.136 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 m -84.98 -22.21 29.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 74.13 111.381 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -113.0 128.7 56.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.828 0.347 . . . . 72.32 111.283 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -78.9 179.89 7.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 74.34 110.447 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.82 -58.48 8.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.84 0.353 . . . . 73.44 110.537 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.49 -26.38 67.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.109 -0.496 . . . . 75.54 110.6 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.67 -40.4 94.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.114 0.483 . . . . 71.11 110.261 179.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 17.4 mt -77.42 -30.04 53.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.659 -0.701 . . . . 74.51 111.036 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 17.8 t -79.11 -43.33 24.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.942 0.401 . . . . 70.05 110.752 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 75.4 m -60.05 -34.49 73.49 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.895 -0.593 . . . . 73.44 110.486 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.418 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -82.01 -21.72 36.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.006 -0.543 . . . . 71.53 110.898 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.409 ' CD1' ' O ' ' A' ' 63' ' ' TYR . 16.3 t80 -83.79 -22.78 31.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 72.31 110.97 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -85.07 -54.33 4.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.136 -0.483 . . . . 65.34 111.479 -179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.492 ' CE1' ' CE2' ' A' ' 37' ' ' PHE . 2.9 p-80 -62.08 -25.34 67.64 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.16 -0.473 . . . . 74.34 111.385 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.439 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 3.4 tt -53.65 -39.89 65.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.967 0.413 . . . . 74.04 110.945 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.401 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.2 m-85 -79.06 -39.88 32.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.93 -0.577 . . . . 72.22 110.641 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.1 -40.31 90.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.985 -0.552 . . . . 72.41 110.957 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 57.9 p -88.06 -9.77 52.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.033 -0.53 . . . . 74.45 111.413 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.21 33.63 12.87 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.763 0.316 . . . . 72.14 111.192 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 66.6 mtt-85 -92.52 46.18 1.23 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.356 -0.384 . . . . 73.21 111.019 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.439 ' CD1' HD21 ' A' ' 66' ' ' LEU . 91.9 m-85 -67.17 175.8 2.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 65.43 110.856 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 49.4 tttt . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.352 -0.385 . . . . 74.12 110.882 179.949 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.423 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.779 0.323 . . . . 74.32 110.959 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 30.8 p90 -149.46 162.23 40.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 75.02 110.819 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 5.8 m -132.0 103.55 6.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 75.43 111.058 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -111.09 145.16 39.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.207 -0.451 . . . . 74.0 110.797 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.408 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.5 m -137.97 130.77 29.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 75.11 110.941 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 22.1 t -80.47 106.32 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 63.45 111.14 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.408 HD12 ' O ' ' A' ' 114' ' ' SER . 7.4 mp -76.28 -50.01 15.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.224 -0.444 . . . . 75.02 110.768 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.85 111.55 16.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.089 -0.505 . . . . 74.21 110.902 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.95 142.35 46.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 75.11 110.904 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.478 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -114.57 -155.78 11.27 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.741 -0.742 . . . . 72.3 112.615 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -37.21 -52.43 1.05 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.013 0.435 . . . . 72.5 111.415 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 71.22 35.84 1.49 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.789 -0.642 . . . . 73.2 110.178 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 57.2 m -152.98 -43.81 0.1 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.712 -0.676 . . . . 73.23 110.692 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -92.73 95.85 9.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 74.42 110.838 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -107.41 146.12 32.64 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.138 -0.483 . . . . 74.4 110.756 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -56.35 125.34 18.75 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.429 2.086 . . . . 74.02 112.454 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.02 150.37 22.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.981 -0.554 . . . . 63.32 110.909 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -53.93 114.18 1.49 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.42 . . . . 72.34 110.856 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.14 -23.62 33.87 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.58 -0.819 . . . . 71.33 112.356 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -81.58 135.59 35.56 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.817 0.341 . . . . 73.4 110.628 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.544 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 12.8 m -73.62 175.78 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.284 0.564 . . . . 72.44 111.795 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.597 ' O ' ' HA ' ' A' ' 163' ' ' SER . 20.5 m -157.29 146.37 10.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.247 -0.888 . . . . 71.24 110.509 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.451 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -125.43 117.29 23.35 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.983 -0.287 . . . . 72.31 110.624 179.623 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . 0.447 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 30.9 p -153.97 167.07 30.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.951 0.405 . . . . 75.52 111.151 -179.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.432 ' CE3' HG13 ' A' ' 149' ' ' ILE . 62.2 m95 -99.67 160.73 14.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.922 -0.581 . . . . 75.44 110.074 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 34.3 p90 -158.63 134.97 9.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.102 0.477 . . . . 73.41 111.747 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.89 111.67 14.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.72 -0.673 . . . . 74.53 110.188 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.564 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.66 144.04 17.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.562 -0.828 . . . . 73.45 113.27 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -150.62 142.11 23.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.806 0.336 . . . . 63.35 110.554 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 87.7 mt -77.96 -178.21 5.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.262 -0.426 . . . . 74.5 110.93 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -58.86 -43.33 90.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.296 -0.411 . . . . 72.23 110.895 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -75.82 -4.72 42.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.96 -0.564 . . . . 63.35 111.448 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 92.61 23.07 27.05 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.679 -0.772 . . . . 74.11 112.655 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.3 m -88.28 108.31 19.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.811 0.339 . . . . 73.44 110.776 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.7 m -71.16 132.64 33.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 74.14 111.275 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -112.19 -31.19 6.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 70.33 110.895 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -143.83 123.03 12.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 73.34 110.98 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 82.9 m -137.45 105.69 5.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 70.23 110.72 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -86.17 12.6 9.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 74.55 111.702 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.447 ' CD1' ' N ' ' A' ' 149' ' ' ILE . 2.6 mp . . . . . 0 C--N 1.332 -0.186 0 CA-C-O 120.83 0.348 . . . . 75.33 110.903 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.786 0.326 . . . . 63.4 111.081 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -146.56 148.22 33.12 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 75.3 110.779 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.84 156.68 65.0 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.474 2.116 . . . . 75.32 112.233 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.2 128.02 32.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.083 -0.508 . . . . 75.33 110.746 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.597 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.6 OUTLIER -105.41 126.68 52.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.27 -0.423 . . . . 62.03 111.054 179.817 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -151.0 140.94 21.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 75.31 110.977 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 10.3 mtpt -69.65 131.25 44.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.333 -0.394 . . . . 74.32 110.828 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.4 m -87.88 149.21 4.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 65.33 111.182 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 67.99 25.09 74.46 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.764 -0.732 . . . . 61.43 112.595 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 15.7 m -134.24 46.17 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.9 0.381 . . . . 75.05 111.121 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.59 35.52 3.0 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.212 -0.518 . . . . 72.43 113.276 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.15 -47.08 12.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.887 0.375 . . . . 73.31 111.056 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -118.48 -179.58 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.049 -0.523 . . . . 64.45 110.971 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.508 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.22 158.39 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.453 -0.34 . . . . 74.21 111.197 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 23.5 ttm180 -66.52 -28.57 68.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.295 -0.411 . . . . 73.3 111.301 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.48 -36.53 43.72 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.659 -0.781 . . . . 64.22 112.16 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.508 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.3 t90 -78.99 -34.37 44.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.916 0.388 . . . . 73.04 111.096 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -62.46 -38.01 88.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 73.35 110.423 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -75.45 -29.82 59.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.986 -0.552 . . . . 75.55 110.644 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -78.76 -58.32 3.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.153 -0.476 . . . . 73.2 111.128 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.48 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 5.8 mt -56.73 -34.38 67.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.983 -0.553 . . . . 71.44 110.898 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 16.4 tp -59.91 -30.34 68.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.248 -0.433 . . . . 74.12 110.694 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 32.5 p -87.11 -3.58 59.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 74.3 111.291 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 71.4 mmm -78.17 154.3 31.27 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.794 0.33 . . . . 70.23 110.718 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 10.4 p -121.19 170.33 9.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 54.42 111.175 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.94 117.43 5.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.011 -0.541 . . . . 74.34 110.776 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . 0.407 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 70.48 66.82 2.08 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.701 -0.762 . . . . 55.02 112.224 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . 0.478 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 19.0 tt0 -146.02 147.25 31.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.636 0.255 . . . . 74.44 110.563 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -121.98 136.54 54.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.761 0.315 . . . . 72.12 110.262 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -150.0 176.16 11.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.076 0.465 . . . . 74.43 111.495 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.76 135.17 36.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.795 -0.639 . . . . 73.42 109.594 178.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.41 ' HG ' ' CE1' ' A' ' 216' ' ' PHE . 1.2 pt? -140.12 140.02 35.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.2 0.524 . . . . 75.42 112.361 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -116.3 112.05 20.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.54 -0.754 . . . . 64.23 109.912 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.45 ' CD1' ' CE2' ' A' ' 216' ' ' PHE . 2.1 mp -97.47 143.08 13.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.001 0.429 . . . . 71.14 111.543 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -76.89 154.88 83.11 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.861 -0.609 . . . . 75.34 110.676 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . 0.438 ' CG ' ' HA ' ' A' ' 211' ' ' ASN . 73.4 Cg_exo -50.89 -39.84 58.36 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.629 2.219 . . . . 74.31 112.419 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.31 -40.63 82.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 73.42 111.235 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . 0.423 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 5.7 m0 -96.64 36.84 1.33 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.396 -0.365 . . . . 73.51 111.147 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -162.83 -76.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 75.52 110.888 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.438 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 25.7 m-85 -106.27 -71.21 0.76 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 73.32 110.672 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 143.05 -179.9 20.25 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.799 -0.715 . . . . 74.44 112.673 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -59.34 -33.06 70.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.846 0.355 . . . . 72.33 110.903 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -51.73 48.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 65.1 110.783 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 113.51 -138.82 15.23 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.868 -0.682 . . . . 73.43 112.474 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . 0.413 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.4 OUTLIER -153.99 79.62 5.12 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.862 0.363 . . . . 62.41 110.824 179.99 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.9 -22.93 25.66 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.577 2.185 . . . . 73.11 112.41 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.8 -41.96 87.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.399 -0.364 . . . . 72.51 110.965 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -111.35 27.89 9.25 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.173 -0.467 . . . . 71.33 111.19 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 55.48 30.83 15.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.233 -0.44 . . . . 75.24 111.077 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . 0.43 HD11 ' CE2' ' A' ' 198' ' ' TYR . 31.1 mt -82.14 112.66 37.57 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.431 . . . . 74.34 111.074 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -60.04 158.99 27.44 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.474 2.116 . . . . 73.01 112.303 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -55.71 145.44 71.2 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.618 2.212 . . . . 71.51 112.284 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . 0.438 ' HA ' ' CG ' ' A' ' 194' ' ' PRO . 3.2 m-80 45.0 40.93 4.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.15 -0.477 . . . . 74.13 111.358 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -83.24 112.27 19.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 73.13 111.796 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.2 mmmm -65.02 140.63 58.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.009 -0.542 . . . . 75.3 110.276 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.438 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 5.4 mt -117.89 109.78 16.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.949 0.405 . . . . 74.22 112.026 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 1.9 m -109.16 142.88 39.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.917 -0.583 . . . . 74.43 110.061 179.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.564 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 14.8 p90 -156.57 -179.27 8.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.118 0.485 . . . . 75.33 111.617 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -131.34 135.16 47.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.612 -0.722 . . . . 74.13 110.418 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.8 t -122.82 150.46 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.457 . . . . 71.52 111.915 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.67 110.45 8.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.733 -0.667 . . . . 75.35 110.256 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . 0.447 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 2.0 tt -69.84 128.55 36.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.39 -0.368 . . . . 72.31 111.02 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 24.6 t -108.51 -29.07 2.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.158 -0.474 . . . . 64.52 111.296 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . 0.4 ' HB3' ' CD2' ' A' ' 132' ' ' HIS . 5.4 t70 -170.41 161.14 7.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.881 0.372 . . . . 72.13 111.006 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 41.7 mt -140.19 110.62 3.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.096 -0.502 . . . . 73.23 111.057 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 74.03 110.859 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 50.3 t . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.637 0.256 . . . . 63.45 111.157 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -81.59 138.84 10.97 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.738 2.292 . . . . 75.0 112.325 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -81.14 148.84 29.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 75.51 111.052 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.92 120.59 5.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 74.25 111.102 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -94.95 -10.96 29.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.065 -0.516 . . . . 72.34 111.403 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.445 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 3.8 m-90 -138.19 173.67 11.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.912 0.386 . . . . 74.1 110.863 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.3 m -118.22 152.06 36.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.009 -0.541 . . . . 75.02 110.661 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 34.2 t -57.71 -33.34 44.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.369 -0.378 . . . . 74.41 110.685 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -77.37 -24.94 50.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.964 -0.562 . . . . 62.52 111.037 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.03 -57.65 3.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.832 0.348 . . . . 74.34 110.843 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mt -51.1 -60.71 2.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.221 -0.445 . . . . 72.24 111.001 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -54.16 -24.14 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 75.24 111.114 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.12 177.86 0.31 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.307 -0.406 . . . . 70.15 111.045 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -110.31 16.72 21.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.935 -0.575 . . . . 72.21 111.167 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -104.39 -27.86 11.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.514 -0.312 . . . . 73.24 111.156 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.445 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 6.5 tt -86.84 132.16 42.97 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.394 -0.366 . . . . 75.31 111.015 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -74.48 124.97 9.28 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.52 2.147 . . . . 74.44 112.398 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -26.33 59.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 74.42 111.188 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 mmtp -54.65 -49.06 71.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.301 -0.409 . . . . 75.5 111.293 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.05 -33.17 74.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.127 -0.488 . . . . 75.42 111.19 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.473 HG23 HD13 ' A' ' 25' ' ' ILE . 30.1 mt -66.9 -36.53 77.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 72.34 111.223 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 15.8 mt -71.85 -50.16 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.229 -0.442 . . . . 74.3 111.105 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.35 -22.9 45.53 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.847 -0.615 . . . . 73.42 111.286 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -74.46 -50.81 16.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.013 0.435 . . . . 72.44 110.809 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.4 ' O ' ' N ' ' A' ' 33' ' ' GLY . 4.5 mt -64.3 -39.17 93.37 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.87 -0.605 . . . . 73.24 110.957 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -71.18 -20.22 62.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.309 -0.405 . . . . 74.51 110.727 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 9.4 tp10 -79.58 -52.21 8.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.133 -0.485 . . . . 64.54 111.472 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.422 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 84.4 m-70 -111.18 16.48 21.0 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.876 0.325 . . . . 73.23 111.876 -179.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' A' ' 29' ' ' LEU . . . -123.05 91.08 0.44 Allowed Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.517 -0.849 . . . . 73.02 112.631 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.1 p -33.68 156.08 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.672 0.619 . . . . 73.43 112.672 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -51.45 -55.91 16.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.673 -0.694 . . . . 73.2 111.443 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.2 t -47.83 -48.05 31.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.04 0.447 . . . . 64.41 110.702 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.493 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 15.9 t80 -55.05 -49.0 72.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.678 -0.692 . . . . 75.5 110.727 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.433 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 11.6 mt -62.54 -45.54 92.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 73.12 110.937 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -49.93 -31.89 13.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.295 -0.411 . . . . 62.31 111.309 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -71.35 -33.15 69.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 74.11 111.034 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -110.03 13.32 23.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.348 -0.387 . . . . 75.02 111.502 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt 58.86 33.67 23.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.794 0.331 . . . . 72.42 111.004 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 17.8 mt -88.76 -20.1 25.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.28 -0.418 . . . . 73.03 111.107 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.433 ' N ' ' HB3' ' A' ' 38' ' ' LEU . 84.1 mt -47.77 170.32 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.894 0.378 . . . . 64.24 111.175 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.45 -154.78 24.45 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.771 -0.728 . . . . 64.41 112.778 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 40.5 m-20 -109.92 150.4 28.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.96 0.41 . . . . 72.44 111.078 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.2 mp -46.71 -39.6 4.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.972 -0.558 . . . . 75.24 111.434 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -60.21 -42.45 95.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.057 -0.52 . . . . 72.41 111.102 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -85.56 -26.62 26.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.077 -0.51 . . . . 52.43 111.216 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 17.5 t -79.58 -25.83 12.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.405 . . . . 73.53 111.448 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.42 -27.74 68.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.388 -0.369 . . . . 60.01 111.127 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.9 ptpp? -95.18 -29.21 14.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 75.33 110.986 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -96.34 33.55 1.76 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.449 . . . . 63.12 111.13 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -163.68 125.79 2.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.366 -0.379 . . . . 75.42 111.123 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.22 174.64 11.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 73.44 110.633 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.68 -58.29 8.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.892 0.377 . . . . 75.2 110.521 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.56 -24.48 67.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.005 -0.543 . . . . 74.55 110.584 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.21 -42.57 99.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.15 -0.477 . . . . 64.22 110.375 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 15.3 mt -74.85 -29.99 61.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.714 -0.675 . . . . 75.32 111.059 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 12.4 t -80.4 -43.87 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.987 0.422 . . . . 73.11 110.824 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.7 m -58.86 -34.33 71.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.93 -0.577 . . . . 73.41 110.532 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.403 ' HA ' ' ND1' ' A' ' 65' ' ' HIS . . . -83.59 -21.77 32.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.997 -0.547 . . . . 75.34 110.952 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -82.29 -22.88 35.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 70.42 111.025 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -85.82 -53.18 5.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 74.2 111.474 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.493 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.2 p-80 -62.76 -27.5 69.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.991 -0.549 . . . . 73.31 111.498 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.428 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.5 tt -50.67 -40.68 54.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.871 0.367 . . . . 73.21 111.091 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -79.05 -40.84 30.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.015 -0.539 . . . . 72.4 110.682 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.82 -38.58 91.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.978 -0.556 . . . . 73.41 111.012 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.9 p -87.35 -11.84 48.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.091 -0.504 . . . . 63.21 111.46 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt 55.07 32.26 17.9 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.737 0.303 . . . . 75.13 111.161 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 30.9 mtt-85 -91.53 47.22 1.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.32 -0.4 . . . . 74.12 111.023 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.422 ' CD1' HD21 ' A' ' 66' ' ' LEU . 96.8 m-85 -68.28 171.84 6.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 75.34 110.855 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.5 tttp . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.28 -0.418 . . . . 74.42 110.928 179.942 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.439 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.742 0.306 . . . . 75.0 111.123 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.426 ' CZ ' ' HB2' ' A' ' 177' ' ' GLU . 4.1 p90 -132.73 -176.56 4.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 73.52 110.622 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.48 105.59 1.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.796 0.332 . . . . 75.33 111.06 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . 0.411 ' CG ' ' CD2' ' A' ' 190' ' ' LEU . 0.0 OUTLIER -101.66 139.92 36.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 75.22 110.808 179.837 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -132.34 122.72 25.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 64.12 110.905 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 9.5 p -84.0 106.38 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.472 . . . . 62.13 111.067 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -87.68 -43.33 12.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 75.42 110.788 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 11.8 ttpp -118.22 107.9 14.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 73.23 110.94 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.08 134.36 55.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.211 -0.45 . . . . 74.14 111.057 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -103.23 -106.03 3.02 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.716 -0.754 . . . . 71.32 112.329 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.79 -42.78 11.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.96 0.41 . . . . 71.03 110.703 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.09 33.9 3.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.952 -0.567 . . . . 74.35 110.836 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 61.2 m -156.32 -45.6 0.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 71.23 110.839 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 -83.22 91.88 7.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 74.25 110.972 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -103.71 141.79 23.24 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 71.03 110.821 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.69 125.55 19.44 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.493 2.128 . . . . 72.22 112.356 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -97.98 158.88 15.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.117 -0.492 . . . . 72.3 110.849 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.91 111.13 1.18 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.275 -0.42 . . . . 74.03 110.809 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 111.33 -36.66 4.09 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.755 -0.736 . . . . 75.45 112.338 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.1 130.93 42.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 64.44 110.677 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.51 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 5.9 m -73.86 179.71 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.98 0.419 . . . . 71.44 111.429 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.594 ' O ' ' HA ' ' A' ' 163' ' ' SER . 21.5 m -156.84 147.69 11.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.8 -0.636 . . . . 74.34 110.916 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.413 ' ND1' ' HB3' ' A' ' 163' ' ' SER . 0.7 OUTLIER -124.94 117.7 24.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.553 -0.294 . . . . 73.13 110.38 179.496 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . 0.466 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.1 p -153.73 166.88 31.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.999 0.428 . . . . 73.34 111.509 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.438 ' CE3' HG12 ' A' ' 149' ' ' ILE . 54.9 m95 -100.44 163.73 12.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.796 -0.638 . . . . 73.21 110.159 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.444 ' CD1' ' HB2' ' A' ' 148' ' ' ASN . 27.9 p90 -159.2 135.19 8.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.888 0.375 . . . . 72.42 111.593 -179.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 3.4 m -122.47 106.39 10.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.088 -0.505 . . . . 64.41 110.941 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.714 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -85.98 135.79 13.67 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.938 -0.649 . . . . 72.03 113.32 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.43 143.19 27.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.802 0.334 . . . . 75.1 110.617 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 32.3 mt -81.95 -177.47 6.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 72.13 110.871 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -56.76 -42.86 80.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.469 . . . . 74.31 110.902 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.61 -9.07 58.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.949 -0.569 . . . . 72.3 111.31 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 93.33 25.86 17.63 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.64 -0.79 . . . . 72.12 112.569 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 30.4 m -87.32 108.59 19.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.808 0.337 . . . . 73.42 110.87 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.2 t -63.72 127.46 24.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 71.41 111.089 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.418 ' CE2' ' HA3' ' A' ' 137' ' ' GLY . 52.1 p90 -110.13 -31.09 7.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.272 -0.422 . . . . 74.41 110.919 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -167.88 112.19 0.66 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 74.52 110.87 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 11.9 t -125.07 126.9 46.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.211 -0.45 . . . . 63.01 110.965 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . 0.444 ' HB2' ' CD1' ' A' ' 135' ' ' TYR . 8.8 t30 -65.58 -21.81 66.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.126 -0.488 . . . . 74.33 111.159 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.438 HG12 ' CE3' ' A' ' 134' ' ' TRP . 21.4 mt . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.393 -0.367 . . . . 70.4 111.417 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.814 0.34 . . . . 72.44 111.052 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 7.4 mtpt -131.13 119.36 17.74 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 72.1 110.881 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.44 151.16 18.83 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.418 2.079 . . . . 74.52 112.26 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 2.5 tt -79.12 127.78 32.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 74.24 110.706 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.594 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 1.1 p -109.02 127.42 54.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.919 0.39 . . . . 63.14 111.346 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -153.13 145.27 23.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.965 -0.562 . . . . 75.45 110.713 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . 0.51 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 15.8 mtmt -71.8 134.34 46.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.959 0.409 . . . . 74.31 111.028 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.0 m -87.93 149.17 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.94 -0.573 . . . . 74.34 111.345 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 62.43 29.24 72.78 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.827 -0.701 . . . . 73.51 112.607 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 35.4 m -116.76 -33.01 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.927 0.394 . . . . 64.15 111.578 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 111.99 31.29 2.72 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.69 -0.767 . . . . 64.15 111.443 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -88.59 -29.71 19.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.759 0.314 . . . . 71.32 111.067 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 14.8 m -121.75 179.63 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 75.25 111.245 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.477 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 2.7 pt -59.58 169.45 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.108 -0.496 . . . . 63.22 111.082 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -76.05 -28.41 57.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.315 -0.402 . . . . 74.41 111.099 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -73.15 -30.57 62.76 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.72 -0.752 . . . . 74.55 112.015 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.508 ' CD1' ' CD1' ' A' ' 190' ' ' LEU . 0.6 OUTLIER -84.05 -34.46 24.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.88 0.372 . . . . 74.12 110.838 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -58.31 -40.76 82.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.036 -0.529 . . . . 73.11 110.488 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . 0.426 ' HB2' ' CZ ' ' A' ' 111' ' ' TYR . 4.8 mt-10 -80.14 -29.4 38.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.847 -0.615 . . . . 74.41 110.631 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -76.07 -60.77 2.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.205 -0.452 . . . . 72.32 111.23 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.441 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 0.3 OUTLIER -56.3 -35.04 67.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.975 -0.557 . . . . 74.41 110.992 -179.95 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.5 tp -64.76 -28.4 69.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 70.01 111.06 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 22.4 m -89.5 -8.81 52.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.3 -0.409 . . . . 74.43 111.444 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -77.6 156.29 30.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.819 0.342 . . . . 75.31 110.963 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.81 168.96 9.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 73.23 110.875 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -68.36 125.31 26.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.272 -0.422 . . . . 73.3 110.99 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 70.28 35.34 69.71 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.834 -0.698 . . . . 75.21 112.597 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -120.37 147.24 45.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.831 0.348 . . . . 75.22 110.922 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt -114.82 140.49 48.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 74.4 110.117 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -147.58 175.86 10.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.028 0.442 . . . . 75.04 111.705 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.23 120.05 26.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.777 -0.647 . . . . 74.33 109.981 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.508 ' CD1' ' CD1' ' A' ' 175' ' ' TRP . 3.5 mt -99.4 161.66 13.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.429 0.633 . . . . 71.42 112.271 -179.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -149.13 105.11 3.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.843 -1.071 . . . . 65.14 109.696 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.45 ' CD1' ' CZ ' ' A' ' 216' ' ' PHE . 3.0 mt -111.7 138.12 41.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.065 0.459 . . . . 75.45 111.798 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.414 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.3 mt-10 -75.84 167.83 33.22 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.647 -0.706 . . . . 62.0 110.445 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . 0.414 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 36.3 Cg_endo -64.8 -15.56 50.91 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.46 2.107 . . . . 74.33 112.633 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.14 -24.78 30.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.567 -0.288 . . . . 72.34 111.701 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . 0.439 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 3.0 m0 -110.37 37.18 2.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.74 0.305 . . . . 74.41 111.558 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -149.78 -83.07 0.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.428 -0.351 . . . . 72.34 111.43 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.456 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 25.5 m-85 -107.72 -31.65 7.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.98 0.419 . . . . 74.15 110.921 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 119.61 169.18 14.13 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.875 -0.679 . . . . 61.4 112.629 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.01 -29.75 44.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.885 0.374 . . . . 73.22 110.834 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -67.34 -46.88 72.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.081 -0.509 . . . . 73.52 110.68 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.56 -141.81 16.74 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.819 -0.705 . . . . 74.33 112.396 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . 0.429 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.0 OUTLIER -155.77 79.41 4.25 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 120.846 0.355 . . . . 71.54 110.773 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.16 -22.68 26.53 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.65 2.233 . . . . 74.13 112.567 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.01 -42.05 84.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.898 0.38 . . . . 65.11 110.992 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.73 31.2 6.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.116 -0.493 . . . . 70.13 111.11 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 18.1 mtpt 56.86 32.95 22.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.246 -0.434 . . . . 75.55 110.935 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . 0.448 HD12 ' CE2' ' A' ' 198' ' ' TYR . 50.4 mt -93.26 111.8 53.55 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.143 -0.481 . . . . 75.12 111.046 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -69.16 170.67 15.32 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.426 2.084 . . . . 61.02 112.384 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.23 151.47 49.04 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.63 2.22 . . . . 74.04 112.461 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 57.15 24.86 10.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 71.11 111.329 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -83.75 147.22 27.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.894 0.378 . . . . 74.43 111.467 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -93.92 156.09 16.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 72.14 110.303 179.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.456 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 14.1 mt -136.4 109.51 7.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.953 0.406 . . . . 65.11 111.857 -179.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 94.9 m -111.27 141.19 45.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.933 -0.576 . . . . 74.53 110.251 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.714 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 21.4 p90 -161.78 120.12 2.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.951 0.405 . . . . 74.52 111.73 -179.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.68 139.45 47.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.022 -0.535 . . . . 75.32 110.813 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.6 t -123.02 151.32 27.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.997 -0.547 . . . . 73.41 111.102 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -136.8 111.32 8.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.281 -0.418 . . . . 64.24 110.639 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . 0.466 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 0.4 OUTLIER -69.56 129.54 39.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.842 0.353 . . . . 73.52 110.835 -179.722 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 40.1 t -107.37 -30.54 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.475 . . . . 74.44 111.07 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -167.74 157.8 10.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.211 -0.45 . . . . 65.32 110.895 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 3.9 mp -141.14 111.31 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 74.41 111.091 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 34.5 t70 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 74.45 110.935 -179.961 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 42.4 t . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 120.602 0.239 . . . . 72.22 110.798 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.454 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.3 Cg_endo -78.48 134.67 12.64 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.654 2.236 . . . . 74.21 112.525 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -80.19 156.54 26.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.178 -0.464 . . . . 74.3 110.807 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.25 93.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 71.45 111.379 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.44 86.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 73.33 110.992 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.414 ' CD1' HD11 ' A' ' 20' ' ' LEU . 1.5 m-90 -115.46 173.64 6.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.966 -0.561 . . . . 73.53 110.689 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.2 154.77 31.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.101 -0.5 . . . . 74.54 110.618 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 95.9 t -57.11 -35.87 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.973 0.416 . . . . 64.31 110.501 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -67.96 -30.34 69.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.87 -0.605 . . . . 73.44 111.143 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -82.04 -56.09 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.37 -0.377 . . . . 74.32 111.238 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.5 mt -49.55 -65.6 0.54 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.285 -0.416 . . . . 75.3 111.327 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.71 -25.49 18.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 65.21 111.259 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.42 173.68 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.99 0.424 . . . . 75.52 111.36 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.38 17.04 21.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.888 -0.596 . . . . 72.41 111.176 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -112.23 -19.98 12.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.655 0.264 . . . . 73.42 111.307 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.414 HD11 ' CD1' ' A' ' 10' ' ' TRP . 2.1 tt -90.59 112.18 51.68 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.609 -0.269 . . . . 75.33 111.008 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -57.69 128.42 29.1 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.411 2.074 . . . . 72.42 112.227 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.4 -24.15 67.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.462 . . . . 74.24 111.204 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -51.76 -40.13 59.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.394 -0.366 . . . . 75.55 111.581 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.89 -57.42 4.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.957 0.408 . . . . 74.34 111.164 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 4.7 mt -44.81 -32.78 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.891 -0.595 . . . . 75.44 111.556 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.4 mt -75.1 -40.7 44.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.937 0.399 . . . . 75.42 110.991 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -71.02 -24.03 62.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.977 -0.556 . . . . 72.02 111.029 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 24.1 t80 -71.47 -45.05 63.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.041 0.448 . . . . 62.32 110.86 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.1 mt -69.57 -24.01 63.64 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.783 -0.644 . . . . 74.52 111.11 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -79.3 -25.05 42.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.348 -0.387 . . . . 74.4 111.005 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.1 -10.58 18.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.384 -0.371 . . . . 72.33 111.24 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 11.9 m170 -117.62 -9.7 10.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.54 -0.3 . . . . 75.52 111.438 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.49 164.4 15.53 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.688 -0.768 . . . . 64.21 112.379 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.98 150.4 21.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.683 0.277 . . . . 61.51 110.555 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -48.55 -57.01 6.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.833 0.349 . . . . 54.51 111.02 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.92 -49.57 39.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.054 0.454 . . . . 70.44 110.625 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.501 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 14.8 t80 -54.61 -48.02 72.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.707 -0.678 . . . . 63.5 110.431 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.402 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 14.6 mt -63.98 -42.02 97.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.933 -0.576 . . . . 75.32 110.837 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.418 ' CB ' HD22 ' A' ' 44' ' ' LEU . . . -46.68 -40.29 12.96 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.187 -0.46 . . . . 71.12 111.05 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.413 ' HB3' ' CD2' ' A' ' 41' ' ' HIS . 0.6 OUTLIER -48.56 -50.13 33.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.806 -0.634 . . . . 73.24 111.09 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.413 ' CD2' ' HB3' ' A' ' 40' ' ' GLU . 5.3 m-70 -102.46 14.04 32.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.088 -0.505 . . . . 74.25 111.293 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.2 mttt 57.47 42.0 25.21 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.842 0.353 . . . . 74.55 110.959 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 19.8 mt -92.25 -22.43 19.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 74.4 111.463 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.418 HD22 ' CB ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -77.6 156.8 30.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.026 0.441 . . . . 72.53 111.23 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.31 -122.27 5.39 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.646 -0.707 . . . . 73.33 112.489 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -116.3 117.76 30.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.814 0.34 . . . . 74.44 110.964 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mp -45.97 -54.96 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.186 -0.461 . . . . 73.24 111.414 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.2 -37.81 16.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.9 -0.591 . . . . 71.03 111.075 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -85.77 -25.58 26.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.009 -0.541 . . . . 72.23 111.13 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 25.1 t -82.35 -25.82 8.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 75.41 111.423 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.21 -15.78 63.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.815 0.341 . . . . 72.3 111.189 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.12 -32.36 13.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 75.55 110.914 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.0 m -88.82 -33.6 17.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.326 -0.397 . . . . 73.53 111.053 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -91.96 125.34 36.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 72.0 111.191 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -82.09 175.83 10.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 73.11 110.602 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.9 tptt -58.42 -58.18 9.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.857 0.36 . . . . 73.54 110.587 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.0 -26.67 68.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.083 -0.508 . . . . 65.4 110.503 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -42.85 99.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.128 -0.487 . . . . 72.21 110.376 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 19.3 mt -71.6 -32.75 68.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.69 -0.686 . . . . 75.24 110.928 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 13.0 t -78.43 -42.29 26.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 74.25 110.94 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.3 m -59.41 -36.94 76.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.964 -0.562 . . . . 74.35 110.64 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.432 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -80.75 -22.17 40.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.019 -0.537 . . . . 75.11 110.999 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 21.6 t80 -83.78 -22.85 31.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 74.24 111.026 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -83.09 -54.73 4.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.279 -0.419 . . . . 74.35 111.545 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.501 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 4.2 p-80 -61.7 -29.13 69.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.098 -0.501 . . . . 71.0 111.366 -179.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.451 ' CD2' ' CD2' ' A' ' 72' ' ' PHE . 5.0 tt -51.98 -39.27 59.09 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.901 0.381 . . . . 74.24 111.118 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -78.81 -36.53 42.54 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.068 -0.514 . . . . 73.14 110.608 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.97 -39.87 83.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.961 -0.563 . . . . 73.43 110.745 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.68 -3.52 52.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.978 -0.556 . . . . 73.25 111.359 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.3 mmtp 48.5 38.97 11.99 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.752 0.31 . . . . 75.41 111.316 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -93.85 43.5 1.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.379 . . . . 64.05 111.111 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.451 ' CD2' ' CD2' ' A' ' 66' ' ' LEU . 86.4 m-85 -66.3 179.61 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.434 . . . . 74.34 110.889 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.9 tttt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 72.41 110.893 179.908 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.413 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.87 0.366 . . . . 74.43 110.819 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -165.66 163.95 19.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 70.12 110.807 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 33.3 m -128.33 129.0 45.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.469 . . . . 75.4 110.668 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 8.0 tttm -128.88 151.47 49.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.31 -0.405 . . . . 61.53 110.972 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.4 m -150.27 123.14 8.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 70.03 110.872 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 29.8 t -80.37 106.33 11.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 75.12 111.454 -179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.5 mp -76.46 -59.99 2.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.143 -0.48 . . . . 73.42 110.497 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -112.94 108.05 16.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.93 -0.577 . . . . 62.01 110.681 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.8 mtmp? -60.97 142.86 56.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 73.03 110.969 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.403 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -110.44 -159.04 16.72 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.773 -0.727 . . . . 65.32 112.211 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -35.03 -46.71 0.33 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.814 0.34 . . . . 63.1 111.654 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 72.6 39.21 0.72 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 73.41 110.3 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -167.71 -42.68 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.686 -0.688 . . . . 71.41 110.423 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -84.71 86.4 7.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.018 -0.537 . . . . 75.13 110.669 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -106.0 155.54 38.23 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.044 -0.525 . . . . 65.0 110.822 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.25 125.53 11.99 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.537 2.158 . . . . 71.15 112.469 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.25 155.66 17.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.095 -0.502 . . . . 74.25 110.867 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 1.1 tptm -56.92 119.23 5.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 75.51 110.945 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 94.44 -9.41 71.73 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.721 -0.752 . . . . 74.01 112.758 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.27 140.15 29.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.871 0.367 . . . . 64.43 110.995 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.439 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 7.3 p -70.86 162.44 4.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.107 -0.497 . . . . 71.51 111.014 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.606 ' O ' ' HA ' ' A' ' 163' ' ' SER . 4.4 m -153.59 144.98 14.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.137 -0.483 . . . . 64.54 111.009 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.451 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.87 117.84 22.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.738 0.304 . . . . 73.41 110.763 179.528 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 30.3 p -150.21 168.94 22.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.077 0.465 . . . . 65.12 111.102 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.446 ' HB3' ' CD1' ' A' ' 149' ' ' ILE . 80.6 m95 -102.64 157.52 16.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.729 -0.669 . . . . 75.45 110.015 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 53.2 p90 -162.23 138.73 7.86 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.148 0.499 . . . . 73.23 112.055 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 22.1 m -131.35 116.23 17.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.478 -0.783 . . . . 73.24 110.335 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.572 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -98.16 145.17 17.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.601 -0.809 . . . . 63.12 113.291 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.9 143.24 27.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.832 0.349 . . . . 62.34 110.75 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 90.7 mt -88.64 -179.53 6.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 73.33 110.756 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -52.88 -45.14 67.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.301 -0.409 . . . . 74.01 111.075 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.0 -13.22 62.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.974 -0.557 . . . . 74.01 111.326 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 88.27 25.85 29.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.651 -0.785 . . . . 73.03 112.59 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -98.27 124.88 43.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.815 0.341 . . . . 74.21 110.817 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.2 t -63.7 129.41 27.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 72.12 111.085 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.416 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 54.1 p90 -110.83 -33.65 6.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 74.25 111.012 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . 0.414 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 13.9 m-20 -162.53 110.27 1.32 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 75.42 110.949 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 9.2 t -142.91 127.68 18.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 74.21 110.951 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 34.2 p-10 -92.71 52.58 1.89 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 75.04 110.385 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.446 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 27.9 mm . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.064 -0.516 . . . . 65.53 110.886 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.817 0.341 . . . . 73.12 111.08 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.25 146.45 36.47 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.02 110.819 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.42 155.84 68.66 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.538 2.159 . . . . 72.33 112.234 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 3.6 tt -75.44 121.44 22.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.31 -0.404 . . . . 75.3 110.576 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.606 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.67 122.29 42.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.946 0.403 . . . . 73.13 111.305 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 10.8 p90 -151.81 143.67 23.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.909 -0.587 . . . . 75.15 110.557 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 4.6 mttp -80.96 138.71 36.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.079 0.466 . . . . 73.31 111.323 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.8 m -87.38 149.42 4.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.618 -0.719 . . . . 75.21 111.188 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.77 21.71 78.86 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.805 -0.712 . . . . 53.23 112.637 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 29.3 m -130.16 41.15 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.871 0.367 . . . . 75.44 111.134 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.47 38.58 5.34 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 121.125 -0.56 . . . . 74.23 113.154 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.69 -41.86 15.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.865 0.364 . . . . 73.13 110.95 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . 0.413 HG11 ' CE3' ' A' ' 175' ' ' TRP . 1.7 m -121.95 179.78 2.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.112 -0.494 . . . . 75.54 110.994 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.506 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -59.88 159.48 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.331 -0.395 . . . . 75.44 111.158 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -67.72 -28.26 67.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.204 -0.453 . . . . 75.32 111.139 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.5 -37.58 46.43 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.668 -0.777 . . . . 61.32 111.958 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.506 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.3 t90 -78.33 -33.48 49.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.919 0.39 . . . . 73.14 110.998 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -64.31 -33.87 76.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.967 -0.561 . . . . 75.33 110.444 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -78.65 -29.71 45.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 71.4 110.662 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -81.16 -45.47 16.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 71.21 111.105 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.494 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 11.8 mt -72.39 -18.92 61.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.016 -0.538 . . . . 74.25 111.167 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.3 tp -56.38 -24.18 42.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.429 -0.351 . . . . 75.34 111.345 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 16.2 p -114.5 18.09 16.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.627 -0.26 . . . . 75.3 111.618 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 3.5 mmm -68.13 103.48 1.56 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.869 0.366 . . . . 73.02 110.913 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.22 148.99 49.06 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.195 -0.457 . . . . 75.13 110.839 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 3.2 ttmt -54.85 115.77 2.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.506 . . . . 70.31 111.216 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 77.39 20.05 75.48 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.921 -0.656 . . . . 60.02 113.201 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . 0.403 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.6 tt0 -93.69 146.48 23.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.867 0.333 . . . . 73.3 111.032 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -119.22 136.23 54.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 74.44 109.936 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -150.57 176.25 11.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.106 0.479 . . . . 73.43 111.831 -179.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.88 133.52 33.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.604 -0.726 . . . . 73.22 109.477 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.442 ' CD2' ' CE1' ' A' ' 216' ' ' PHE . 1.6 pt? -140.07 141.53 36.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.135 0.493 . . . . 74.45 112.109 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -116.94 112.39 20.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.549 -0.75 . . . . 65.41 110.021 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . . . . . . . . . 1.3 mm -92.18 150.26 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.922 0.391 . . . . 74.31 111.214 -179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -83.37 166.4 35.04 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.525 . . . . 72.53 110.69 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -66.91 -14.76 44.95 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.532 2.155 . . . . 73.1 112.6 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -84.23 -31.18 25.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 72.54 111.034 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . 0.413 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 14.4 m0 -107.54 37.03 2.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.416 . . . . 74.22 111.075 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -154.44 -81.06 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 75.52 111.087 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.42 ' CE2' HD13 ' A' ' 208' ' ' ILE . 41.7 m-85 -106.11 -71.31 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.033 0.444 . . . . 74.13 110.762 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 151.34 176.56 24.28 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.721 -0.752 . . . . 71.25 112.597 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.31 -30.01 36.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.857 0.36 . . . . 74.42 110.798 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -49.73 19.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 74.44 110.686 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 107.35 -128.22 9.13 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.836 -0.697 . . . . 53.02 112.536 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . 0.413 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.0 OUTLIER -156.69 82.34 3.34 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.871 0.367 . . . . 73.43 110.753 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.57 -24.57 29.51 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.634 2.223 . . . . 71.3 112.481 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.42 -42.02 96.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.845 0.355 . . . . 75.41 111.027 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -103.53 28.83 6.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 70.25 111.257 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.43 29.8 15.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.268 -0.424 . . . . 73.43 111.023 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . 0.42 HD13 ' CE2' ' A' ' 198' ' ' TYR . 40.2 mt -90.49 111.68 48.77 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.219 -0.446 . . . . 71.23 111.07 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.21 170.89 19.14 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.527 2.151 . . . . 74.3 112.429 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.7 142.15 96.99 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.641 2.228 . . . . 71.13 112.177 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 47.82 76.67 0.11 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.356 -0.384 . . . . 75.4 111.116 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.08 113.56 17.91 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.357 -0.383 . . . . 75.34 111.581 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.57 126.84 29.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.134 -0.485 . . . . 75.12 110.253 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.417 HD12 ' CE2' ' A' ' 198' ' ' TYR . 13.0 mt -103.35 109.45 21.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.851 0.358 . . . . 72.13 111.556 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 20.5 m -103.26 136.85 42.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 71.32 110.617 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.572 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 29.3 p90 -155.38 176.3 12.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.061 0.458 . . . . 64.41 111.539 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -131.63 135.29 46.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.707 -0.679 . . . . 75.43 110.612 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 2.3 t -121.95 149.99 25.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.11 0.481 . . . . 73.43 111.924 -179.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -136.91 110.46 8.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.737 -0.665 . . . . 74.22 110.453 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.93 130.76 43.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.345 . . . . 70.22 110.897 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 18.3 t -110.25 -30.13 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.221 -0.445 . . . . 73.24 111.633 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -168.86 158.61 8.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.865 0.364 . . . . 62.42 111.069 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 3.4 mp -142.12 112.12 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 71.41 111.097 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-O 121.073 0.463 . . . . 73.15 110.826 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.407 ' CG1' ' CG2' ' A' ' 136' ' ' THR . 33.2 t . . . . . 0 CA--C 1.528 0.128 0 CA-C-O 120.595 0.236 . . . . 74.45 111.044 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.428 ' HD2' ' CE2' ' A' ' 72' ' ' PHE . 92.4 Cg_endo -78.98 139.56 15.36 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.607 2.205 . . . . 71.4 112.428 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -80.62 151.87 28.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.168 -0.469 . . . . 74.32 110.827 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.82 92.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.2 -0.455 . . . . 73.54 111.299 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.89 -35.45 76.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 71.05 111.027 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 2.4 m-90 -114.62 173.68 6.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.087 -0.506 . . . . 73.53 110.866 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -118.25 154.33 32.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.081 -0.509 . . . . 73.32 110.644 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 43.7 t -55.13 -34.28 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.353 -0.385 . . . . 54.15 110.927 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -65.01 -32.38 74.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.108 -0.496 . . . . 72.51 110.839 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -82.05 -56.1 4.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.346 -0.388 . . . . 73.24 110.835 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.3 mt -50.21 -28.75 8.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.202 -0.454 . . . . 75.12 110.82 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -94.63 -28.7 15.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.766 -0.652 . . . . 72.43 110.337 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.4 t -53.12 170.2 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.881 -0.6 . . . . 74.44 111.314 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -103.69 17.11 24.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.733 -0.667 . . . . 73.33 111.123 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -113.65 -20.66 11.12 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.489 -0.323 . . . . 75.34 111.357 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.2 tt -84.78 129.48 56.61 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.591 -0.277 . . . . 73.43 110.959 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -77.23 125.64 7.97 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.5 2.133 . . . . 55.51 112.255 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -24.1 66.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 74.42 110.952 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.26 -35.21 62.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.282 -0.417 . . . . 75.34 111.465 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.26 -54.48 6.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.966 0.413 . . . . 64.25 111.046 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.428 HD13 HG23 ' A' ' 25' ' ' ILE . 29.1 mt -45.0 -32.9 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 64.21 111.38 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 6.1 mt -76.51 -49.97 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 74.32 110.925 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 34.8 mttm -64.8 -25.57 67.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.812 -0.631 . . . . 75.24 111.115 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -70.4 -45.38 66.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.997 0.427 . . . . 75.24 110.834 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.4 mt -69.97 -36.48 75.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.851 -0.613 . . . . 74.02 110.946 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -69.59 -20.72 63.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.176 -0.465 . . . . 73.14 110.707 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.2 -51.06 5.35 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.148 -0.478 . . . . 72.34 110.963 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -88.87 0.91 56.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 71.52 111.612 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.38 160.45 14.33 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.673 -0.775 . . . . 71.13 112.445 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -92.55 151.87 19.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.547 0.213 . . . . 71.24 110.458 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.94 -57.12 6.98 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.81 0.338 . . . . 73.22 111.176 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -47.78 -51.65 21.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.059 0.457 . . . . 62.23 110.842 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.508 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 10.8 t80 -52.76 -47.51 67.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.82 -0.627 . . . . 73.24 110.477 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.413 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 11.2 mt -66.32 -40.88 90.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.073 -0.512 . . . . 72.33 110.764 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.431 ' CB ' HD21 ' A' ' 44' ' ' LEU . . . -47.83 -47.51 31.3 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.056 0.455 . . . . 71.13 111.079 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -57.64 -26.91 62.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.765 -0.652 . . . . 74.03 110.895 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 43.9 m-70 -112.63 11.16 19.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.276 -0.42 . . . . 75.3 111.261 179.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt 51.15 35.47 13.3 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.858 0.361 . . . . 74.33 110.93 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 29.1 mt -94.18 -20.34 19.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.132 -0.485 . . . . 73.45 111.736 -179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.431 HD21 ' CB ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.69 158.76 26.89 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.046 0.45 . . . . 71.33 111.121 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 114.57 -119.37 4.67 Favored Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 115.798 -0.637 . . . . 75.24 112.404 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -116.34 113.79 23.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.751 0.31 . . . . 74.21 110.9 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mp -45.58 -54.64 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.192 -0.458 . . . . 74.42 111.374 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.27 -36.55 9.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.87 -0.605 . . . . 72.24 110.92 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -85.64 -25.23 26.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.992 -0.549 . . . . 74.53 111.102 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.7 t -83.45 -25.81 7.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.297 -0.41 . . . . 73.42 111.479 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.0 -15.83 63.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.37 -0.377 . . . . 73.33 111.41 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -95.19 -34.02 12.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.818 0.342 . . . . 74.1 110.999 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.8 t -87.94 -30.56 19.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.46 . . . . 65.51 111.081 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.45 125.8 37.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.427 . . . . 73.32 111.132 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.09 174.84 10.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 71.25 110.642 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -58.1 9.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.861 0.363 . . . . 73.21 110.505 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.59 -26.99 68.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.121 -0.491 . . . . 75.34 110.573 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.91 -43.4 98.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.095 -0.502 . . . . 70.44 110.475 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 20.4 mt -73.48 -32.64 64.41 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.713 -0.676 . . . . 73.41 110.973 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 15.9 t -76.9 -42.39 32.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.005 0.431 . . . . 74.55 110.695 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.0 m -60.73 -33.44 72.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.869 -0.605 . . . . 73.34 110.516 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.13 -22.25 39.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.483 . . . . 75.32 111.045 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -83.66 -22.9 32.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.099 -0.5 . . . . 73.11 111.126 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -83.95 -54.16 5.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.046 0.45 . . . . 74.3 111.294 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.508 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 3.1 p-80 -60.78 -31.09 70.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.02 -0.536 . . . . 65.11 111.036 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.449 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.7 tt -46.1 -41.12 11.89 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.899 0.381 . . . . 64.14 111.162 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -78.13 -42.14 32.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.018 -0.537 . . . . 74.31 110.268 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -70.03 -13.07 62.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.853 -0.612 . . . . 70.05 110.933 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.444 ' N ' ' O ' ' A' ' 65' ' ' HIS . 35.8 p -108.72 -16.07 14.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.179 -0.464 . . . . 71.25 111.195 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.29 30.65 17.11 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.793 0.33 . . . . 75.32 110.942 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -96.1 44.27 1.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 74.44 111.047 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.431 ' CD2' HD22 ' A' ' 66' ' ' LEU . 75.5 m-85 -66.86 175.95 2.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 75.33 110.696 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 74.32 110.879 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.416 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.784 0.326 . . . . 72.54 110.987 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -152.36 171.5 17.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.307 -0.406 . . . . 73.1 110.88 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' THR . . . . . 0.409 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 0.2 OUTLIER -134.52 129.22 34.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 75.41 110.56 179.828 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.32 151.54 39.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 74.2 111.056 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.3 m -150.08 114.1 5.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.144 -0.48 . . . . 71.44 110.875 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 9.7 p -80.7 106.6 12.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.249 -0.432 . . . . 75.35 111.134 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.4 mp -78.31 -77.11 0.17 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.476 . . . . 72.32 111.076 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -96.76 110.0 22.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.267 -0.424 . . . . 74.11 111.08 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.2 mtmt -59.43 139.6 56.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.804 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.507 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -111.68 -154.78 12.88 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.682 -0.77 . . . . 73.42 112.659 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -37.29 -52.92 1.09 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.049 0.452 . . . . 65.43 111.412 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 tmtp? 71.85 36.17 1.24 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.793 -0.64 . . . . 74.04 110.234 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -156.91 -44.61 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.791 -0.64 . . . . 73.35 110.775 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -87.59 97.08 10.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.117 -0.492 . . . . 74.44 110.919 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -109.41 154.82 42.04 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.089 -0.505 . . . . 75.13 110.642 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.59 125.47 11.2 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.515 2.143 . . . . 73.14 112.439 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.1 tttm -92.99 160.22 14.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 75.22 110.899 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -57.89 119.47 6.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.286 -0.415 . . . . 73.11 110.947 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 87.45 1.8 83.21 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.745 -0.74 . . . . 75.11 112.833 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -92.13 139.41 30.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.878 0.37 . . . . 74.33 110.967 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.413 ' CG2' ' N ' ' A' ' 131' ' ' VAL . 4.4 p -71.66 162.04 4.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.066 -0.515 . . . . 75.03 110.909 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.629 ' O ' ' HA ' ' A' ' 163' ' ' SER . 9.3 m -154.56 145.58 13.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.042 -0.526 . . . . 71.52 110.987 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.452 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -128.35 117.95 22.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.728 0.299 . . . . 75.05 110.936 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . 0.419 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 29.1 p -154.26 170.3 21.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.919 0.39 . . . . 65.54 111.196 -179.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.428 ' CE3' HG13 ' A' ' 149' ' ' ILE . 66.3 m95 -104.19 161.01 14.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.938 -0.574 . . . . 74.52 110.149 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.415 ' CD1' ' N ' ' A' ' 135' ' ' TYR . 4.5 p90 -159.5 134.98 8.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.03 0.443 . . . . 73.42 111.702 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.407 ' CG2' ' CG1' ' A' ' 5' ' ' VAL . 22.5 m -127.83 113.55 16.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 72.03 110.307 179.467 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.574 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.18 144.2 17.06 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.629 -0.796 . . . . 61.25 113.342 -179.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.44 130.77 13.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.756 0.312 . . . . 72.52 110.457 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 91.3 mt -66.02 -178.0 0.56 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.395 -0.366 . . . . 73.21 110.849 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -56.7 -42.3 78.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 75.33 110.76 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.46 -5.22 56.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.97 -0.559 . . . . 73.11 111.395 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 95.89 25.76 12.62 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.624 -0.798 . . . . 65.12 112.634 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.89 113.02 18.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.876 0.37 . . . . 74.41 110.837 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 11.3 p -71.6 121.42 21.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 73.42 111.136 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.427 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 53.3 p90 -113.28 -17.08 12.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 71.32 111.315 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.09 127.52 7.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.797 0.332 . . . . 73.42 110.951 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.87 98.01 3.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 75.54 111.005 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -77.26 -9.16 58.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.224 -0.444 . . . . 73.52 111.075 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.465 ' CD1' ' N ' ' A' ' 149' ' ' ILE . 2.5 mp . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.383 -0.371 . . . . 62.55 110.962 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.796 0.331 . . . . 74.41 111.092 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -129.83 128.4 22.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 74.22 110.89 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.09 148.2 40.65 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.411 2.074 . . . . 74.2 112.314 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.409 HD21 ' CD1' ' A' ' 164' ' ' PHE . 0.3 OUTLIER -73.47 120.76 19.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 70.12 110.532 179.797 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.629 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -103.55 122.7 45.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.944 0.402 . . . . 73.51 111.336 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . 0.415 ' CE2' HG22 ' A' ' 171' ' ' VAL . 25.2 p90 -153.74 145.58 23.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.002 -0.544 . . . . 74.44 110.637 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -80.75 138.49 36.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.128 0.489 . . . . 73.52 111.29 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 17.8 m -87.27 149.35 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.652 -0.704 . . . . 73.24 111.05 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.0 23.7 76.91 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.777 -0.725 . . . . 74.42 112.408 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -132.55 39.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.939 0.4 . . . . 73.02 110.926 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 47.36 38.77 13.34 Favored Glycine 0 C--N 1.33 0.202 0 C-N-CA 121.02 -0.609 . . . . 61.22 112.85 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.5 -47.05 11.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.915 0.388 . . . . 74.4 110.872 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . 0.415 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.2 OUTLIER -120.08 -179.68 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.96 -0.564 . . . . 74.35 111.022 179.898 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.488 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 4.0 pt -59.64 161.02 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.32 -0.4 . . . . 74.44 111.285 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -69.07 -27.88 66.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 75.2 110.986 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.83 -37.75 38.29 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.673 -0.775 . . . . 62.3 112.03 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.488 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.7 t90 -78.44 -33.43 48.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.921 0.391 . . . . 74.44 111.09 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -69.05 -29.05 67.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.973 -0.558 . . . . 64.41 110.695 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -81.76 -28.72 33.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 75.42 110.827 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -85.27 -51.55 6.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.277 -0.42 . . . . 73.24 111.212 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.449 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 2.9 mt -54.39 -36.71 64.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.991 -0.55 . . . . 75.14 110.773 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 3.1 tp -54.15 -25.02 20.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 73.31 110.996 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.16 -0.0 57.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 62.4 111.445 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 23.2 mmm -80.54 150.14 29.7 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.867 0.365 . . . . 62.24 110.909 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.52 171.08 8.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.104 -0.498 . . . . 71.31 111.18 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 3.6 tttt -62.7 117.1 5.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.037 -0.529 . . . . 74.42 110.68 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . 0.401 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 69.07 65.63 2.54 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.617 -0.802 . . . . 72.41 112.398 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . 0.507 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.5 tt0 -145.05 145.14 31.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.663 0.268 . . . . 63.0 110.503 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.9 ttpt -118.36 135.88 54.06 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.194 -0.299 . . . . 73.12 110.194 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -144.43 172.82 12.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.125 0.488 . . . . 73.31 111.864 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.52 118.22 14.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.53 -0.759 . . . . 72.41 109.817 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.42 ' CD2' ' CE1' ' A' ' 216' ' ' PHE . 2.1 pt? -128.73 139.84 52.02 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.016 0.436 . . . . 74.53 111.795 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.79 114.87 23.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.792 -0.64 . . . . 75.24 110.544 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.428 HD13 ' CZ ' ' A' ' 216' ' ' PHE . 3.1 mt -105.0 142.43 18.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.229 -0.441 . . . . 75.2 111.521 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.426 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.3 OUTLIER -72.05 168.57 21.78 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.907 -0.588 . . . . 74.25 110.592 179.818 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . 0.426 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 24.7 Cg_endo -61.93 -35.07 79.56 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.352 2.035 . . . . 73.5 112.224 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -60.37 -39.91 88.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 71.12 111.099 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . 0.416 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 16.8 m0 -96.98 36.87 1.36 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.343 -0.39 . . . . 64.0 110.974 -179.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -160.8 -78.45 0.05 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.067 -0.515 . . . . 74.43 110.742 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.428 ' CE2' ' CD1' ' A' ' 208' ' ' ILE . 36.0 m-85 -105.98 -71.25 0.75 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 74.34 110.535 179.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 141.03 -177.21 21.11 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.815 -0.707 . . . . 51.51 112.85 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 18.4 mttm -59.21 -34.65 72.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.816 0.341 . . . . 72.43 110.932 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -61.57 -52.8 62.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 73.3 110.64 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 97.17 173.6 34.29 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.874 -0.679 . . . . 73.22 112.551 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . 0.417 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.3 OUTLIER -111.23 93.51 18.61 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.654 0.264 . . . . 75.22 110.743 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.97 -26.37 51.32 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.527 2.151 . . . . 64.43 112.443 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -60.86 -42.18 97.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.946 0.403 . . . . 74.43 110.849 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -99.21 27.43 5.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.043 -0.526 . . . . 75.34 111.231 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.1 29.44 14.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.27 -0.423 . . . . 74.02 111.038 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . 0.428 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 40.6 mt -94.14 111.46 53.39 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.317 -0.401 . . . . 74.53 110.987 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.33 172.32 6.65 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.554 2.169 . . . . 74.21 112.25 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.2 128.64 12.31 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.612 2.208 . . . . 73.53 112.241 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 63.26 69.54 0.57 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.3 -0.409 . . . . 53.14 110.711 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.68 156.98 34.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 75.42 111.39 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -88.57 141.72 28.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.962 -0.563 . . . . 73.22 110.381 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.416 HD11 ' CE2' ' A' ' 198' ' ' TYR . 3.5 mt -125.68 109.07 12.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.379 . . . . 71.23 111.518 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 4.3 m -113.07 142.9 45.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.953 -0.567 . . . . 63.13 110.511 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.574 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 18.4 p90 -155.08 -179.86 8.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.438 . . . . 74.54 111.371 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -132.53 135.96 46.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.702 -0.681 . . . . 73.4 110.409 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 4.2 t -121.14 150.9 24.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.098 0.475 . . . . 74.23 111.809 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -136.74 107.96 6.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.654 -0.703 . . . . 72.32 110.163 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . 0.419 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 2.3 tt -69.99 130.0 41.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.426 -0.352 . . . . 73.32 110.809 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 24.7 t -108.8 -30.14 2.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.253 -0.43 . . . . 73.23 111.423 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -170.0 160.16 8.1 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.901 0.381 . . . . 70.4 111.236 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 31.9 mt -142.83 111.82 2.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.03 -0.532 . . . . 75.32 111.014 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.243 -0.435 . . . . 74.43 110.902 179.98 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.0 t . . . . . 0 CA--C 1.529 0.139 0 CA-C-O 120.515 0.197 . . . . 73.24 110.846 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.451 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 88.9 Cg_endo -80.9 140.2 12.6 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.622 2.215 . . . . 75.41 112.623 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -83.87 154.62 23.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 75.44 110.863 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.57 89.92 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.114 -0.493 . . . . 70.13 111.47 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.83 -32.38 67.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 74.45 111.18 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.455 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 1.9 m-90 -118.63 173.86 6.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 74.33 110.927 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -116.66 153.08 32.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.962 -0.563 . . . . 70.25 110.424 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 24.1 t -55.96 -33.74 36.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.926 0.394 . . . . 55.11 111.009 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -71.13 -27.67 63.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.986 -0.552 . . . . 73.23 111.286 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.34 -56.38 3.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.811 0.339 . . . . 73.35 111.208 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mt -49.51 -65.07 0.63 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.245 -0.434 . . . . 62.14 111.228 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.0 mtt180 -53.55 -25.1 15.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 75.35 111.258 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.69 172.72 0.16 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.941 0.401 . . . . 72.31 111.239 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -110.3 16.84 21.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.92 -0.582 . . . . 53.4 111.254 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -111.34 -23.58 10.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.568 -0.287 . . . . 71.52 111.224 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.455 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 10.1 tt -87.12 116.52 66.35 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.458 -0.337 . . . . 75.05 110.921 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.45 123.27 13.22 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.384 2.056 . . . . 75.4 112.237 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.4 -24.11 66.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 74.42 111.308 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -53.16 -35.24 59.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.421 -0.354 . . . . 70.12 111.295 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -77.56 -49.74 14.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.287 -0.415 . . . . 72.11 110.921 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.436 HG23 HD11 ' A' ' 25' ' ' ILE . 25.1 mt -47.03 -36.91 3.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.898 -0.592 . . . . 72.23 111.246 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 10.7 mt -72.04 -49.26 45.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 72.32 110.848 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.23 -23.43 48.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.69 -0.687 . . . . 71.42 111.098 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -74.23 -49.78 21.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.002 0.43 . . . . 73.5 111.061 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.5 mt -66.3 -28.55 68.77 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.872 -0.603 . . . . 73.55 111.291 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -76.21 -28.01 57.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.52 -0.309 . . . . 73.33 111.016 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.424 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 10.7 pt-20 -89.91 -38.48 13.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.832 0.348 . . . . 71.32 110.817 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.451 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 42.4 m170 -100.49 16.61 24.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 73.23 110.982 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.6 152.11 21.49 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.831 -0.7 . . . . 63.44 112.512 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.8 p -92.73 156.52 16.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.642 0.258 . . . . 75.42 110.604 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -48.0 -54.68 12.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.765 0.316 . . . . 70.2 111.31 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 82.5 p -51.06 -46.69 61.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.023 0.439 . . . . 75.33 110.695 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 22.2 t80 -57.11 -48.18 79.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.745 -0.661 . . . . 64.14 110.775 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.429 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 11.8 mt -63.24 -46.87 84.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 71.53 110.909 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -49.46 -31.05 9.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 71.24 111.243 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -72.92 -32.46 65.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 71.21 111.073 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.413 ' CG ' ' HB1' ' A' ' 62' ' ' ALA . 6.7 m-70 -110.14 12.14 23.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.377 -0.374 . . . . 75.44 111.548 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 59.96 32.13 20.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.747 0.308 . . . . 74.2 111.01 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.5 mt -85.93 -22.05 27.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.257 -0.429 . . . . 74.12 111.042 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.429 ' N ' ' HB3' ' A' ' 38' ' ' LEU . 92.4 mt -48.01 170.47 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.931 0.396 . . . . 63.24 111.234 179.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.88 -160.13 32.15 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.846 -0.692 . . . . 64.44 112.796 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -102.62 147.11 27.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.963 0.411 . . . . 74.13 111.065 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mp -45.36 -43.59 3.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.889 -0.596 . . . . 74.34 111.513 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -43.15 72.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.981 -0.554 . . . . 75.21 111.047 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -85.68 -28.95 24.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.956 -0.565 . . . . 73.24 111.22 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.8 t -73.01 -27.57 24.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.299 -0.41 . . . . 74.14 111.454 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.51 -25.86 66.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.427 -0.351 . . . . 54.35 111.359 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.25 -27.38 15.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.287 -0.415 . . . . 75.31 111.244 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.4 m -84.33 -21.43 30.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.353 -0.385 . . . . 74.33 111.414 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -120.58 131.48 54.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.795 0.331 . . . . 74.23 111.349 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -77.81 -178.12 5.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 74.22 110.474 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -58.42 8.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.816 0.341 . . . . 74.52 110.536 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.24 -26.72 67.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.143 -0.481 . . . . 72.45 110.664 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.67 -37.95 83.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.108 0.48 . . . . 72.4 110.249 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 14.2 mt -76.25 -31.71 58.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.614 -0.721 . . . . 74.23 110.955 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 15.1 t -78.46 -42.81 26.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.051 0.453 . . . . 71.34 110.705 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 32.8 m -59.27 -35.6 74.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.842 -0.617 . . . . 72.51 110.493 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.413 ' HB1' ' CG ' ' A' ' 41' ' ' HIS . . . -81.76 -20.85 38.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.024 -0.535 . . . . 74.24 110.957 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.413 ' CD1' ' O ' ' A' ' 63' ' ' TYR . 8.2 t80 -83.67 -22.99 31.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.194 -0.457 . . . . 75.33 110.86 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -85.6 -53.91 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 74.24 111.369 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.449 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.2 p-80 -60.99 -28.29 68.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.111 -0.495 . . . . 73.53 111.136 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.437 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.8 tt -50.27 -40.51 48.35 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.977 0.417 . . . . 72.13 110.973 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.418 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.4 m-85 -78.95 -37.48 39.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.892 -0.594 . . . . 63.31 110.578 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.04 -40.47 91.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.893 -0.594 . . . . 74.31 110.999 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.01 -9.53 48.29 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.076 -0.511 . . . . 71.54 111.278 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.59 33.73 19.79 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.741 0.305 . . . . 75.53 111.244 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -90.56 46.29 1.32 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.387 -0.37 . . . . 74.15 111.078 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.428 ' CE2' ' HD2' ' A' ' 6' ' ' PRO . 93.3 m-85 -67.32 169.77 8.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.293 -0.412 . . . . 75.25 110.742 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.1 ttmm . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.329 -0.396 . . . . 70.21 110.861 179.889 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.865 0.364 . . . . 75.52 110.893 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 6.2 p90 -173.03 153.82 2.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 64.13 110.897 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 19.7 m -115.85 130.55 56.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.276 -0.42 . . . . 72.22 110.327 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 4.6 tttt -127.65 144.85 51.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.926 0.393 . . . . 74.52 111.227 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.3 m -142.51 119.81 11.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 74.52 110.681 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 27.5 t -80.29 106.36 11.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.431 . . . . 73.22 111.211 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.402 ' CD2' ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -79.33 -49.36 12.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.214 -0.448 . . . . 75.12 110.795 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -121.8 107.99 12.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 75.34 110.957 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.6 mttm -63.03 143.63 57.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.223 -0.444 . . . . 71.44 110.895 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -106.15 -165.05 23.0 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.687 -0.768 . . . . 72.5 112.409 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -36.56 -42.57 0.36 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.846 0.355 . . . . 64.22 111.826 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.6 tttt 74.55 42.22 0.31 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.135 -0.484 . . . . 74.54 110.582 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 69.1 m -164.26 -43.37 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.946 -0.57 . . . . 71.34 110.722 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -86.83 101.12 13.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 72.11 110.911 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -120.24 147.67 45.47 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 72.23 110.834 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.37 127.63 26.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.56 2.174 . . . . 75.3 112.547 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -99.18 152.19 20.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 75.12 110.706 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.48 114.05 1.52 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.335 -0.393 . . . . 74.53 111.114 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 93.44 -2.37 70.64 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.762 -0.732 . . . . 72.31 112.982 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -92.15 137.77 32.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.919 0.39 . . . . 72.43 111.071 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.434 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 7.5 p -70.05 161.27 4.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.078 -0.51 . . . . 75.52 110.971 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.623 ' O ' ' HA ' ' A' ' 163' ' ' SER . 5.5 m -153.58 144.71 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 75.22 111.07 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.475 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.96 117.75 22.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.543 -0.299 . . . . 65.13 110.805 179.753 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . 0.405 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 30.2 p -150.12 168.09 24.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.0 0.429 . . . . 74.14 111.182 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.457 ' HB3' ' CD1' ' A' ' 149' ' ' ILE . 51.3 m95 -101.89 157.76 16.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.813 -0.63 . . . . 75.1 109.747 179.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.46 ' CE1' ' CB ' ' A' ' 148' ' ' ASN . 49.8 p90 -162.45 139.06 7.78 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.296 -0.561 . . . . 74.13 112.22 -179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 81.1 m -129.26 112.48 13.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.466 -0.788 . . . . 73.22 110.457 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.617 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.73 146.15 18.11 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.598 -0.81 . . . . 72.11 113.184 -179.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -152.21 147.1 26.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.789 0.328 . . . . 74.21 110.833 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 41.4 mt -80.5 -178.37 6.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 74.14 110.694 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -56.92 -43.82 81.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.901 0.382 . . . . 71.13 111.018 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.7 -6.61 47.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.996 -0.547 . . . . 65.4 111.462 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 92.43 20.45 35.04 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.666 -0.778 . . . . 63.54 112.729 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.48 113.8 25.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 73.11 110.675 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 5.7 m -63.68 138.5 22.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 74.14 111.134 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.421 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 40.3 p90 -117.81 -40.96 2.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 60.51 110.929 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -154.53 115.2 3.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.067 -0.515 . . . . 75.03 110.715 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 6.9 t -142.76 126.97 17.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.302 -0.408 . . . . 72.34 111.237 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . 0.46 ' CB ' ' CE1' ' A' ' 135' ' ' TYR . 22.3 t30 -89.01 55.44 3.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.196 0.522 . . . . 75.33 109.915 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.457 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 45.3 mm . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.74 -0.664 . . . . 74.41 111.05 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.848 0.356 . . . . 73.24 111.094 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.4 tttt -146.34 116.06 4.65 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.446 . . . . 60.21 110.855 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . 0.42 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 53.8 Cg_exo -52.41 155.05 10.31 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.376 2.05 . . . . 74.53 112.258 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.65 117.83 16.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 75.41 110.517 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.623 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -100.6 123.31 44.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.939 0.399 . . . . 74.45 111.474 -179.733 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 11.7 p90 -153.38 145.41 23.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.965 -0.561 . . . . 73.31 110.528 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 9.6 mtpt -81.17 138.9 35.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.136 0.493 . . . . 75.33 111.248 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 6.2 m -87.3 149.37 4.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.566 -0.743 . . . . 70.25 111.128 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.63 22.82 78.04 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.836 -0.697 . . . . 74.34 112.6 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 28.0 m -131.24 40.52 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.35 . . . . 74.14 111.111 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.52 38.06 6.94 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 121.071 -0.585 . . . . 53.03 113.135 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.51 -47.0 11.81 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.94 0.4 . . . . 75.22 110.983 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -119.0 -179.48 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.001 -0.545 . . . . 75.2 111.026 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.506 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.8 158.89 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.316 -0.402 . . . . 74.23 111.281 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 17.0 ttm105 -67.73 -27.88 67.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.271 -0.422 . . . . 75.13 110.965 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.1 -38.06 48.17 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.694 -0.765 . . . . 72.11 111.881 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.506 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.2 t90 -78.6 -33.0 47.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.993 0.425 . . . . 74.11 110.883 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.91 -32.17 73.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.877 -0.601 . . . . 73.21 110.538 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -80.84 -28.93 35.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.055 -0.52 . . . . 71.31 110.665 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -80.7 -56.36 4.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 65.33 111.059 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.449 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 6.2 mt -56.01 -31.3 62.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.924 -0.58 . . . . 73.23 110.797 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.4 tp -53.41 -28.88 32.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.085 -0.507 . . . . 72.34 111.344 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 27.1 p -105.65 4.59 30.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.372 -0.376 . . . . 74.52 111.793 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 5.3 mtp -74.33 101.98 4.23 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.903 0.383 . . . . 75.15 110.89 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.9 161.39 18.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.927 -0.579 . . . . 74.44 111.409 -179.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.86 117.65 5.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.56 -0.745 . . . . 74.13 111.2 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 81.65 10.42 84.33 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.869 -0.682 . . . . 64.05 113.137 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -86.18 151.07 23.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 71.21 111.27 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -127.42 138.16 52.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.998 -0.546 . . . . 75.2 109.976 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.05 172.5 13.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.226 0.536 . . . . 75.34 112.147 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.82 101.09 4.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.391 -0.822 . . . . 75.13 109.715 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -122.18 147.94 45.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.121 0.486 . . . . 74.03 111.881 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -120.47 120.53 36.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.705 -0.68 . . . . 73.1 110.564 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.471 ' CD1' ' CZ ' ' A' ' 216' ' ' PHE . 5.0 mp -100.49 139.46 21.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 74.23 111.347 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -77.0 164.88 56.41 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.933 -0.576 . . . . 74.22 110.756 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.93 -42.0 73.25 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.588 2.192 . . . . 72.34 112.303 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -52.29 -30.41 27.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 72.03 111.379 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . . . . . . . . . 23.7 m0 -115.6 36.95 3.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.404 -0.362 . . . . 74.32 111.227 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -154.93 -85.2 0.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.447 -0.342 . . . . 73.22 111.25 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.421 ' CE2' HG13 ' A' ' 208' ' ' ILE . 28.7 m-85 -107.55 -33.47 7.32 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.043 0.449 . . . . 75.44 110.624 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 109.29 173.1 20.95 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.912 -0.661 . . . . 53.54 112.821 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -32.57 70.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.788 0.328 . . . . 74.44 110.831 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -56.78 -54.71 43.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.203 -0.453 . . . . 64.33 110.643 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 117.87 -162.4 13.08 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.833 -0.699 . . . . 72.02 112.673 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . 0.419 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 1.6 tm0? -153.02 84.99 4.37 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.85 0.357 . . . . 70.23 110.355 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -48.67 -49.67 14.26 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.803 2.335 . . . . 74.42 113.048 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -50.93 -42.32 59.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.914 0.388 . . . . 72.14 111.088 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -95.65 26.75 3.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.033 -0.53 . . . . 73.35 111.384 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 4.0 mptt 47.84 30.68 1.99 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.83 0.348 . . . . 73.24 111.075 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . 0.421 HG13 ' CE2' ' A' ' 198' ' ' TYR . 22.7 mm -92.81 111.71 52.48 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 74.25 111.28 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.99 160.88 39.67 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.414 2.076 . . . . 75.31 112.17 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -51.33 115.3 1.98 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.473 2.115 . . . . 73.23 112.298 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 66.24 73.53 0.37 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.232 -0.44 . . . . 62.34 110.912 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -126.22 124.68 40.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.248 -0.433 . . . . 74.03 111.329 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 3.8 tptm -65.67 151.82 45.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.106 -0.497 . . . . 72.51 110.578 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.411 HD11 ' CE2' ' A' ' 198' ' ' TYR . 6.1 mt -130.48 109.42 10.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.814 0.34 . . . . 73.33 111.405 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 3.8 m -106.38 139.72 40.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 63.11 110.573 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.617 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 6.4 p90 -156.44 178.75 9.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.107 0.48 . . . . 75.22 111.514 -179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -133.01 137.13 46.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.613 -0.721 . . . . 74.34 110.279 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 2.3 t -124.15 151.26 29.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.107 0.48 . . . . 72.25 112.086 -178.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -136.88 110.98 8.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.598 -0.728 . . . . 64.11 110.132 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . 0.405 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 2.9 tt -70.83 128.04 34.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.84 0.352 . . . . 73.32 110.988 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 15.5 t -104.97 -30.43 2.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.125 -0.488 . . . . 63.34 111.571 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -171.21 162.46 6.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.867 0.365 . . . . 74.31 111.239 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 30.2 mt -143.49 112.23 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.006 -0.543 . . . . 70.13 110.964 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 72.44 110.89 179.999 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 38.5 t . . . . . 0 CA--C 1.528 0.123 0 CA-C-O 120.661 0.267 . . . . 75.41 111.217 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -77.12 132.89 13.04 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.731 2.287 . . . . 72.25 112.401 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 7.2 mm100 -79.79 146.54 32.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 73.43 110.943 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.412 ' HG3' ' CE2' ' A' ' 67' ' ' PHE . 0.0 OUTLIER -50.81 115.63 1.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.036 -0.529 . . . . 74.32 111.192 -179.829 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -89.25 -39.39 13.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.226 -0.443 . . . . 70.11 110.871 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.416 ' CD1' HD21 ' A' ' 20' ' ' LEU . 1.5 m-90 -104.36 160.05 15.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.023 -0.535 . . . . 72.14 110.703 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 m -99.26 151.87 20.55 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.048 -0.524 . . . . 74.52 110.533 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.444 ' O ' ' CG ' ' A' ' 16' ' ' ARG . 44.0 t -56.67 -37.0 50.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.922 0.392 . . . . 75.52 110.437 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.419 ' O ' ' HB2' ' A' ' 17' ' ' SER . 2.1 tt0 -66.02 -27.4 68.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.962 -0.563 . . . . 75.52 110.86 179.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.413 ' O ' ' HB2' ' A' ' 17' ' ' SER . 6.3 mt-30 -80.08 -54.53 5.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.985 -0.552 . . . . 74.42 111.564 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.417 HD12 ' CD2' ' A' ' 63' ' ' TYR . 2.0 mt -50.07 -66.69 0.35 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.727 0.298 . . . . 72.41 111.797 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.444 ' CG ' ' O ' ' A' ' 12' ' ' VAL . 1.5 ptm180 -60.59 -26.21 66.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.383 -0.371 . . . . 73.44 111.371 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.419 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 0.4 OUTLIER -50.85 177.28 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.928 0.394 . . . . 73.42 111.273 -179.92 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.19 16.68 21.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.946 -0.57 . . . . 74.43 111.107 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -117.6 -19.32 9.44 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.418 -0.356 . . . . 75.44 111.273 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.416 HD21 ' CD1' ' A' ' 10' ' ' TRP . 1.6 tm? -84.58 121.74 74.87 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.508 -0.315 . . . . 71.22 110.852 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.84 123.25 10.49 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.428 2.086 . . . . 62.34 112.369 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.4 ' HB2' ' CD1' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -66.15 -24.23 66.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.11 -0.495 . . . . 75.31 111.403 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -53.43 -45.56 69.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.411 -0.358 . . . . 75.34 111.494 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.98 -23.29 48.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.162 -0.472 . . . . 72.11 111.475 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 57.1 mt -70.74 -43.22 77.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.925 0.393 . . . . 74.23 111.127 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.0 mt -68.72 -40.19 81.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.017 -0.538 . . . . 73.43 111.102 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -67.18 -25.83 66.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.001 -0.545 . . . . 75.04 111.062 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -70.04 -43.76 70.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.033 0.444 . . . . 73.31 110.875 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.8 mt -72.79 -21.35 61.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.888 -0.597 . . . . 74.42 111.04 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -82.68 -24.13 33.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.412 -0.358 . . . . 75.0 111.029 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.82 1.65 31.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.374 -0.375 . . . . 74.33 111.417 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -131.86 -10.66 3.45 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.687 0.255 . . . . 75.24 111.687 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.81 167.66 12.48 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.738 -0.744 . . . . 51.31 112.41 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.7 p -93.86 149.87 20.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.58 0.229 . . . . 74.12 110.489 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.07 -56.98 6.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.807 0.337 . . . . 74.55 110.994 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.2 m -48.41 -50.7 29.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 75.44 110.832 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.487 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 17.6 t80 -54.06 -48.03 71.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.853 -0.612 . . . . 75.23 110.492 179.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 13.2 mt -66.71 -41.79 87.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.094 -0.503 . . . . 72.31 110.784 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.429 ' CB ' HD22 ' A' ' 44' ' ' LEU . . . -47.57 -47.71 28.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.989 0.423 . . . . 73.0 111.206 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -57.51 -27.22 62.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.812 -0.631 . . . . 74.44 110.982 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -112.53 9.81 19.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.314 -0.403 . . . . 65.34 111.231 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.4 37.77 28.27 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.94 0.4 . . . . 72.13 110.664 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 17.7 mt -95.94 -19.74 19.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.986 -0.552 . . . . 75.21 111.851 -179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.429 HD22 ' CB ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -82.11 155.76 24.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.078 0.466 . . . . 74.21 111.101 -179.853 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.37 -122.63 5.5 Favored Glycine 0 N--CA 1.452 -0.292 0 CA-C-N 115.648 -0.705 . . . . 74.43 112.429 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.0 m-80 -116.34 115.43 25.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.736 0.303 . . . . 74.22 111.059 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.5 mp -44.85 -53.5 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.178 -0.465 . . . . 75.1 111.447 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.56 -37.2 7.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.868 -0.605 . . . . 75.44 111.05 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -85.69 -26.58 25.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 72.11 111.255 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.4 t -82.79 -26.56 8.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.432 -0.349 . . . . 72.54 111.597 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.95 -17.85 64.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.427 -0.351 . . . . 61.34 111.454 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 ptpt -95.06 -31.96 13.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.445 -0.343 . . . . 74.22 111.09 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -87.88 -33.68 18.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.24 -0.436 . . . . 75.21 111.131 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -91.21 128.58 37.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.29 -0.414 . . . . 71.21 111.239 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -84.88 178.63 7.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 71.04 110.678 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -60.03 -58.1 10.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.91 0.386 . . . . 75.34 110.653 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -27.4 69.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.072 -0.513 . . . . 63.54 110.522 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.02 -41.45 96.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 72.52 110.431 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.4 ' CD1' ' HB2' ' A' ' 22' ' ' LYS . 20.3 mt -75.55 -30.15 59.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.7 -0.682 . . . . 75.11 110.99 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 18.8 t -78.26 -42.91 27.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.305 -0.407 . . . . 73.5 110.93 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.7 m -61.98 -33.92 75.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.948 -0.569 . . . . 74.13 110.792 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.41 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -80.86 -23.49 39.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 62.14 111.107 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.417 ' CD2' HD12 ' A' ' 15' ' ' LEU . 71.8 t80 -83.66 -22.86 32.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 74.11 110.953 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -82.88 -54.65 4.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.048 -0.524 . . . . 63.54 111.373 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.487 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 3.4 p-80 -63.0 -26.0 68.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.072 -0.513 . . . . 74.32 111.433 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.435 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.6 tt -54.57 -39.04 67.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.847 0.356 . . . . 73.1 111.026 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.412 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 5.2 m-85 -78.98 -38.16 37.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.106 -0.497 . . . . 70.32 110.574 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.63 -40.53 84.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.97 -0.559 . . . . 70.03 110.78 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 75.1 p -90.34 -4.66 56.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.95 -0.568 . . . . 75.22 111.467 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 48.36 37.73 9.19 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.703 0.287 . . . . 71.23 111.287 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.414 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 41.2 mtt180 -94.25 44.03 1.11 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.38 -0.373 . . . . 75.25 111.115 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.416 ' CD2' HD21 ' A' ' 66' ' ' LEU . 81.5 m-85 -65.69 -178.29 0.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 62.42 110.783 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.289 -0.414 . . . . 74.11 110.948 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.42 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.757 0.313 . . . . 74.54 110.987 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 45.0 p90 -154.89 -176.81 6.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 74.43 110.81 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -161.46 104.93 1.26 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.332 -0.394 . . . . 73.4 110.733 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.7 ptmm? -98.46 151.4 20.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.983 0.42 . . . . 73.54 111.241 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 2.1 m -148.61 111.67 4.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.887 -0.597 . . . . 74.51 110.391 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 26.1 t -73.58 106.29 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.305 -0.407 . . . . 75.52 111.324 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.5 mp -75.54 -32.02 60.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 73.24 110.508 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.7 tttt -140.35 110.47 6.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.036 -0.529 . . . . 75.22 110.668 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.0 tptt -57.99 134.76 56.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.262 -0.426 . . . . 75.11 110.968 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.505 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -108.63 -155.08 17.23 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.713 -0.756 . . . . 75.32 112.425 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -36.07 -53.44 0.78 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.008 0.432 . . . . 73.2 111.445 -179.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 70.87 33.71 2.12 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.816 -0.629 . . . . 73.51 110.248 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 62.7 m -154.51 -45.13 0.09 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.753 -0.658 . . . . 70.21 110.683 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -89.08 92.57 9.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.119 -0.492 . . . . 74.22 110.84 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -102.83 154.91 37.18 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.117 -0.492 . . . . 75.31 110.847 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 125.5 12.23 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.522 2.148 . . . . 64.33 112.332 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.44 152.42 18.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 75.12 110.925 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.48 118.98 6.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 74.14 110.859 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 97.36 -16.04 61.28 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.699 -0.763 . . . . 74.22 112.606 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -84.09 140.41 31.83 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.876 0.369 . . . . 74.0 110.969 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.461 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 8.4 p -71.04 163.45 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 75.25 111.041 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.613 ' O ' ' HA ' ' A' ' 163' ' ' SER . 13.0 m -154.91 146.26 13.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.171 -0.468 . . . . 74.44 111.063 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.492 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -128.01 117.76 22.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.718 0.294 . . . . 75.1 110.838 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . 0.426 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 26.1 p -155.27 170.18 22.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.927 0.394 . . . . 64.41 111.047 -179.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.419 ' CZ2' ' HG3' ' A' ' 161' ' ' PRO . 38.2 m95 -106.08 164.6 11.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.949 -0.569 . . . . 74.22 110.308 179.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.464 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 12.3 p90 -162.08 137.07 7.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.926 0.394 . . . . 71.41 111.433 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.06 114.07 16.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.949 -0.568 . . . . 74.21 110.466 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.588 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.64 144.78 17.44 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.615 -0.802 . . . . 73.51 113.407 -179.184 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.95 136.78 18.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.702 0.286 . . . . 74.23 110.367 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 17.1 mt -68.45 -179.05 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.857 0.36 . . . . 75.04 111.035 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -57.04 -41.78 79.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.025 -0.534 . . . . 75.14 110.862 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.37 0.99 39.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 64.23 111.446 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 91.48 25.83 22.34 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.645 -0.788 . . . . 74.53 112.619 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.95 108.35 16.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.773 0.32 . . . . 75.3 110.835 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 11.3 p -68.81 125.34 26.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 65.02 111.138 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.429 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 21.3 p90 -109.96 -22.2 11.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 74.2 111.002 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -162.06 137.9 7.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.401 -0.363 . . . . 75.15 110.836 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 52.3 m -142.8 106.25 4.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 75.22 111.016 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . 0.464 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 13.8 t30 -82.11 -14.81 55.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 74.44 111.226 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.41 ' HA ' ' CE3' ' A' ' 134' ' ' TRP . 25.4 mm . . . . . 0 C--N 1.332 -0.181 0 CA-C-O 120.822 0.344 . . . . 73.33 111.096 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.855 0.359 . . . . 73.22 111.038 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -145.01 135.29 11.9 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 73.03 110.887 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . 0.419 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 52.6 Cg_exo -54.68 163.49 3.86 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.445 2.097 . . . . 73.42 112.276 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.452 ' CD2' ' CD1' ' A' ' 164' ' ' PHE . 2.4 tt -84.54 119.41 25.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 72.42 110.595 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.613 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -95.17 121.79 37.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.897 0.379 . . . . 45.53 111.175 -179.93 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . 0.452 ' CD1' ' CD2' ' A' ' 162' ' ' LEU . 8.2 p90 -149.1 140.68 23.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.082 -0.508 . . . . 74.54 110.742 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 56.1 mttt -80.68 137.41 36.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.076 0.465 . . . . 73.12 111.118 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 5.8 m -87.36 149.8 3.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.668 -0.696 . . . . 75.24 111.13 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.19 22.92 77.53 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.836 -0.697 . . . . 54.42 112.576 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 30.2 m -132.92 40.9 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.896 0.379 . . . . 61.03 111.032 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 49.12 38.85 26.0 Favored Glycine 0 CA--C 1.517 0.218 0 C-N-CA 120.936 -0.649 . . . . 71.53 112.896 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 3.1 mmtt -83.02 -46.5 12.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.901 0.381 . . . . 75.4 110.78 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . 0.417 HG12 ' CE3' ' A' ' 175' ' ' TRP . 0.2 OUTLIER -123.35 -179.06 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.923 -0.581 . . . . 74.43 110.923 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.48 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 4.4 pt -57.16 161.37 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.316 -0.402 . . . . 64.33 111.382 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 31.8 ttm180 -69.7 -25.43 63.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 73.51 111.036 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -78.63 -38.55 23.98 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.743 -0.742 . . . . 61.23 112.187 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.48 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 3.4 t90 -75.66 -32.36 60.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.902 0.382 . . . . 74.32 111.36 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -72.04 -33.54 68.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.038 -0.528 . . . . 64.54 110.817 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -74.52 -28.98 61.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.115 -0.493 . . . . 63.13 110.83 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -87.98 -50.69 6.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.272 -0.422 . . . . 63.01 111.257 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.479 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 8.4 mt -52.55 -37.12 57.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.078 -0.51 . . . . 74.24 110.885 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 6.9 tp -50.97 -26.17 5.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.097 -0.501 . . . . 74.44 111.418 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.52 3.04 55.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.345 . . . . 75.12 111.624 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 4.7 ttt -79.95 148.99 30.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.752 0.311 . . . . 63.43 110.879 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -118.38 169.68 9.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.427 . . . . 73.52 111.26 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.76 118.52 8.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.859 -0.61 . . . . 73.0 110.659 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 68.01 64.1 3.31 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.687 -0.768 . . . . 60.33 112.476 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . 0.505 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 14.2 tt0 -144.02 147.7 34.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.575 0.226 . . . . 72.01 110.5 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 6.1 tttt -115.94 132.83 56.53 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.066 -0.346 . . . . 74.14 110.066 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.57 170.34 15.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.072 0.463 . . . . 73.25 111.729 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.08 101.39 7.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.653 -0.703 . . . . 72.05 109.892 179.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.414 ' HB2' ' CE1' ' A' ' 216' ' ' PHE . 4.9 mp -99.32 118.17 35.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.044 0.45 . . . . 75.3 112.106 -178.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -110.72 107.71 17.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.666 -0.697 . . . . 73.2 109.574 178.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.435 HG12 ' CE2' ' A' ' 216' ' ' PHE . 3.6 mm -98.29 141.77 15.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.012 0.434 . . . . 74.01 111.639 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -81.53 166.66 36.65 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.868 -0.606 . . . . 73.11 110.372 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -60.84 -48.72 9.96 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.427 2.084 . . . . 74.53 112.302 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -51.62 -26.32 8.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 54.52 111.442 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . 0.42 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 10.1 m0 -117.61 37.02 4.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.487 -0.324 . . . . 75.44 111.216 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -158.01 -82.9 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.5 -0.318 . . . . 72.22 111.471 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.433 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 22.7 m-85 -99.61 -30.36 12.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.855 0.36 . . . . 75.42 111.021 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 103.31 175.46 26.29 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.811 -0.709 . . . . 74.11 112.67 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 7.9 ttmt -57.6 -40.05 78.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.881 0.372 . . . . 74.32 110.848 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -44.6 96.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.059 -0.519 . . . . 70.22 110.607 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 109.14 -154.31 16.53 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.851 -0.69 . . . . 70.32 112.487 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . 0.423 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.6 OUTLIER -139.82 87.3 12.91 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.718 0.294 . . . . 73.32 110.703 179.932 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.11 -22.12 67.64 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.54 2.16 . . . . 74.41 112.471 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.61 -42.11 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.882 0.372 . . . . 73.25 110.866 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -109.79 23.32 14.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.112 -0.494 . . . . 72.12 111.401 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt 56.36 54.4 7.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 74.44 111.067 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . 0.402 HG23 ' CD2' ' A' ' 198' ' ' TYR . 20.2 mm -110.57 111.71 57.0 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 74.33 111.055 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.08 161.05 7.14 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.43 2.086 . . . . 63.43 112.342 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.18 129.35 15.97 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.594 2.196 . . . . 75.24 112.313 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 67.86 37.09 3.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.335 -0.393 . . . . 73.4 110.918 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -91.75 157.45 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.256 -0.429 . . . . 72.21 111.326 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.5 155.97 18.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 75.12 110.507 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.433 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 32.4 mt -136.21 109.26 7.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.905 0.383 . . . . 75.54 111.314 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 38.6 m -109.71 137.04 48.09 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.075 -0.511 . . . . 74.23 110.941 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.588 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 13.7 p90 -153.6 178.02 10.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 75.12 111.039 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -134.07 137.64 44.77 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.926 -0.579 . . . . 70.12 110.541 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.75 150.97 23.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.131 0.491 . . . . 74.13 111.976 -178.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -136.72 107.58 6.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.612 -0.722 . . . . 75.31 109.953 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 221' ' ' VAL . 1.0 OUTLIER -70.84 130.57 42.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.433 -0.349 . . . . 70.21 110.913 -179.672 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . 0.433 ' N ' HD22 ' A' ' 220' ' ' LEU . 25.3 t -107.35 -31.47 2.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.351 -0.386 . . . . 72.54 111.465 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -169.56 160.58 9.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.884 0.373 . . . . 75.03 111.235 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 44.7 mt -140.56 110.02 3.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.111 -0.495 . . . . 75.32 111.028 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 73.51 110.911 179.928 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.2 t . . . . . 0 CA--C 1.528 0.114 0 CA-C-O 120.705 0.288 . . . . 75.32 110.965 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.454 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 73.7 Cg_endo -76.48 136.44 17.5 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.654 2.236 . . . . 75.53 112.382 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -80.66 152.91 28.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.453 . . . . 74.14 110.867 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.7 114.55 1.18 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 72.44 111.173 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -87.75 -38.49 15.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.092 -0.503 . . . . 73.44 110.843 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.424 ' CD1' HD11 ' A' ' 20' ' ' LEU . 1.7 m-90 -112.79 173.69 6.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.955 -0.566 . . . . 74.1 110.708 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -115.09 150.86 35.3 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.063 -0.517 . . . . 75.05 110.69 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.2 t -56.04 -32.81 34.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.012 0.434 . . . . 73.22 110.668 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -75.62 -24.68 56.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.803 -0.635 . . . . 74.21 110.969 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.04 -57.46 3.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.85 0.357 . . . . 75.24 110.803 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.66 -63.41 1.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.28 -0.418 . . . . 71.33 110.952 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -53.84 -24.38 15.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 74.45 111.194 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.9 177.46 0.15 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.009 0.433 . . . . 74.14 111.255 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.38 17.08 21.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.826 -0.625 . . . . 71.21 111.151 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -106.83 -24.76 11.96 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.527 -0.306 . . . . 65.32 111.263 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.424 HD11 ' CD1' ' A' ' 10' ' ' TRP . 6.3 tt -93.98 117.8 67.21 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.517 -0.31 . . . . 74.42 111.051 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.07 127.2 23.35 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.419 2.079 . . . . 73.53 112.076 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -24.13 67.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 75.1 111.162 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -53.91 -39.73 66.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.343 -0.389 . . . . 74.11 111.523 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -73.74 -55.09 6.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.896 0.379 . . . . 70.33 111.015 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.419 HD13 HG22 ' A' ' 25' ' ' ILE . 28.7 mt -44.71 -33.65 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.862 -0.608 . . . . 75.41 111.379 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 6.8 mt -76.02 -39.87 37.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 74.3 110.868 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.2 mtpt -72.15 -26.15 61.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.976 -0.556 . . . . 73.01 111.044 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.486 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 33.8 t80 -69.57 -44.63 70.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.05 0.452 . . . . 75.12 110.742 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 mt -71.7 -24.39 61.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.705 -0.68 . . . . 72.41 110.992 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -76.38 -24.11 54.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.298 -0.41 . . . . 73.24 110.703 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -103.39 -10.19 18.82 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.253 -0.43 . . . . 73.51 111.125 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.486 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 12.1 m170 -116.58 -11.2 11.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.405 -0.361 . . . . 72.54 111.324 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -121.06 165.27 14.15 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.708 -0.758 . . . . 61.32 112.42 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -92.6 150.88 20.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.606 0.241 . . . . 74.25 110.515 179.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -48.9 -57.08 7.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.758 0.313 . . . . 61.52 110.941 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.5 m -47.94 -51.97 21.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.018 0.437 . . . . 75.31 110.736 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.493 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 12.5 t80 -52.94 -47.4 68.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.745 -0.662 . . . . 74.22 110.277 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 14.1 mt -65.36 -40.69 93.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.915 -0.584 . . . . 74.42 110.674 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.4 ' CB ' HD23 ' A' ' 44' ' ' LEU . . . -49.59 -43.25 46.2 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.227 -0.442 . . . . 73.22 111.063 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -58.01 -29.32 65.2 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.868 -0.606 . . . . 73.43 110.74 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 -112.82 12.02 19.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 75.53 111.102 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 54.44 37.45 27.76 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.866 0.365 . . . . 74.35 110.748 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.3 mt -94.37 -20.95 19.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 74.34 111.895 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.4 HD23 ' CB ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -78.15 155.53 30.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.099 0.476 . . . . 75.25 111.153 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.92 -124.67 6.1 Favored Glycine 0 N--CA 1.451 -0.302 0 CA-C-N 115.638 -0.71 . . . . 75.25 112.43 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -116.4 119.31 35.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.796 0.331 . . . . 73.33 110.969 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mp -45.69 -52.56 2.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.17 -0.468 . . . . 74.03 111.4 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -47.7 -37.09 12.34 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.909 -0.587 . . . . 74.22 110.842 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -85.58 -26.6 26.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.866 -0.606 . . . . 73.21 110.931 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.5 t -78.59 -26.06 13.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.238 -0.437 . . . . 64.5 111.345 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.33 -25.39 67.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.428 -0.351 . . . . 74.54 111.103 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -95.17 -27.62 15.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 71.31 110.803 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -100.32 33.84 2.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.486 . . . . 74.4 111.012 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -166.76 135.57 2.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 75.02 110.984 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -94.63 177.7 5.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.271 -0.422 . . . . 72.21 110.974 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.62 -57.82 10.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.315 -0.402 . . . . 74.33 110.929 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.54 -26.94 64.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.057 -0.519 . . . . 72.31 110.602 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -63.01 -45.69 91.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.023 -0.535 . . . . 75.13 110.793 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 23.9 mt -73.82 -29.03 61.92 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.714 -0.675 . . . . 75.43 111.202 -179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.1 t -81.08 -43.98 20.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.901 0.382 . . . . 71.32 111.057 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.0 m -59.95 -33.14 71.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.971 -0.559 . . . . 71.43 110.695 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.423 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -84.46 -23.12 30.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 72.52 111.129 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -83.78 -23.03 31.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.257 -0.429 . . . . 71.3 110.981 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 42.9 m-20 -81.79 -55.07 4.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 75.23 111.419 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.493 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 4.2 p-80 -61.65 -29.8 70.3 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.153 -0.476 . . . . 71.23 111.296 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.428 HD23 ' CD2' ' A' ' 72' ' ' PHE . 5.1 tt -50.2 -40.01 45.88 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.891 0.377 . . . . 64.32 111.194 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -79.03 -38.75 35.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.52 . . . . 74.41 110.695 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.45 -41.15 93.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.941 -0.572 . . . . 75.14 110.768 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.2 p -92.64 -2.61 55.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.936 -0.574 . . . . 73.31 111.462 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.13 38.77 10.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.768 0.318 . . . . 74.31 111.353 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.424 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 45.3 mtt-85 -93.13 43.68 1.13 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.308 -0.406 . . . . 72.31 110.992 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.428 ' CD2' HD23 ' A' ' 66' ' ' LEU . 89.8 m-85 -64.5 178.71 0.7 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 75.43 110.826 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.4 ttmm . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.28 -0.418 . . . . 75.25 110.923 179.988 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.426 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.794 0.331 . . . . 71.21 111.018 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 20.3 p90 -157.83 161.93 38.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.299 -0.409 . . . . 74.52 110.84 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 12.2 m -131.46 103.49 6.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 71.4 111.043 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 13.8 tttm -109.59 151.49 26.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 74.24 110.705 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 2.1 m -143.31 128.47 18.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 62.11 110.874 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 9.2 p -78.55 106.34 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.247 -0.433 . . . . 75.35 111.14 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.8 mp -78.94 -78.01 0.16 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.208 -0.451 . . . . 74.23 110.79 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -86.73 108.07 18.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 73.4 110.753 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.44 121.88 12.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.47 . . . . 73.32 111.049 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -100.03 -159.52 28.41 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.74 -0.743 . . . . 71.35 112.139 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 121' ' ' LYS . 0.5 OUTLIER -36.11 -48.87 0.63 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.876 0.369 . . . . 73.02 111.572 -179.479 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 120' ' ' ASP . 20.6 mtpt 67.58 36.9 3.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.845 -0.616 . . . . 75.12 110.349 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -153.91 -44.91 0.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.758 -0.656 . . . . 74.34 110.676 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -88.86 98.47 11.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.14 -0.482 . . . . 74.12 110.853 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -110.61 146.19 33.85 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 72.41 110.842 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.56 125.55 19.35 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.511 2.141 . . . . 63.44 112.453 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.99 152.22 20.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.109 -0.496 . . . . 74.51 110.8 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -55.22 111.59 0.89 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.243 -0.435 . . . . 71.42 110.881 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 99.8 -10.82 60.79 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.742 -0.742 . . . . 60.11 112.708 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -86.92 134.49 33.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.877 0.37 . . . . 70.33 110.953 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.407 ' CG2' ' N ' ' A' ' 131' ' ' VAL . 7.1 p -70.65 163.38 3.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 73.11 110.989 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.617 ' O ' ' HA ' ' A' ' 163' ' ' SER . 15.7 m -155.05 146.55 13.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.241 -0.436 . . . . 74.24 111.017 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.463 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.89 117.91 22.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.735 0.302 . . . . 75.2 110.891 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . 0.431 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 22.3 p -152.48 166.63 31.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 73.43 111.13 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.434 ' HB3' ' CD1' ' A' ' 149' ' ' ILE . 19.1 m95 -101.92 164.22 11.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.056 -0.52 . . . . 73.31 110.239 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.401 ' CD1' ' OD1' ' A' ' 148' ' ' ASN . 28.6 p90 -160.38 135.16 7.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.072 0.463 . . . . 75.04 111.867 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 216' ' ' PHE . 2.9 m -124.74 109.52 13.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.707 -0.679 . . . . 74.41 110.248 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.631 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.55 144.98 17.55 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.613 -0.803 . . . . 51.4 113.414 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.79 149.51 29.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.863 0.363 . . . . 75.54 110.825 179.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 22.7 mt -88.05 -176.37 5.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 74.12 110.845 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -55.87 -43.58 77.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.356 -0.383 . . . . 75.2 110.899 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.07 -16.78 54.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.945 -0.57 . . . . 73.32 111.161 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 107.31 25.86 5.91 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.724 -0.751 . . . . 75.34 112.589 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.5 m -82.06 112.72 19.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.776 0.322 . . . . 73.42 110.867 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.9 t -66.41 126.78 26.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 62.54 111.171 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.434 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 38.7 p90 -114.36 -28.29 7.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.223 -0.444 . . . . 74.13 111.171 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . 0.423 ' HB2' ' CE1' ' A' ' 145' ' ' PHE . 51.6 m-20 -156.24 111.43 2.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.384 -0.371 . . . . 71.14 110.888 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 61.6 m -142.84 108.88 5.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 73.42 111.096 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . 0.401 ' OD1' ' CD1' ' A' ' 135' ' ' TYR . 20.0 p-10 -102.76 25.6 9.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.428 . . . . 75.35 110.909 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.434 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 9.0 mm . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.342 -0.39 . . . . 71.22 110.83 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.1 0 CA-C-O 120.809 0.338 . . . . 74.53 111.097 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 15.4 mttp -146.4 147.7 31.82 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.901 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.95 158.2 57.51 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.6 2.2 . . . . 73.22 112.301 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 1.6 tt -76.43 123.6 26.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 74.13 110.451 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.617 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.3 122.35 42.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.951 0.405 . . . . 74.22 111.411 -179.851 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . 0.405 ' CE2' HG21 ' A' ' 171' ' ' VAL . 6.5 p90 -150.98 143.41 24.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 75.04 110.508 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -82.25 141.64 32.79 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.079 0.466 . . . . 74.14 111.226 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.4 m -87.57 149.15 4.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.779 -0.646 . . . . 63.52 111.167 -179.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.74 24.8 75.43 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.857 -0.687 . . . . 51.52 112.456 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . 0.444 ' O ' ' CG2' ' A' ' 168' ' ' VAL . 8.4 p -131.69 40.93 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.846 0.355 . . . . 74.53 111.103 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 40.6 34.18 0.68 Allowed Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.996 -0.621 . . . . 71.54 112.942 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.24 -34.26 32.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.053 0.454 . . . . 74.31 110.411 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . 0.405 HG21 ' CE2' ' A' ' 164' ' ' PHE . 1.8 m -127.34 179.72 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.799 -0.637 . . . . 72.03 110.83 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.524 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 4.1 pt -58.72 163.84 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.442 -0.344 . . . . 74.51 111.091 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -71.13 -29.21 64.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 72.11 111.197 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.12 -38.09 41.06 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.671 -0.776 . . . . 73.43 112.279 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.524 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.2 t90 -75.22 -32.65 61.21 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.851 0.357 . . . . 75.52 110.996 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -61.94 -43.95 97.79 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 63.33 110.524 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -68.35 -30.82 69.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.903 -0.59 . . . . 74.31 110.751 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -78.0 -61.97 1.83 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.202 -0.454 . . . . 65.23 111.379 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.472 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 6.7 mt -56.07 -31.71 63.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.043 -0.526 . . . . 75.33 111.102 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 35.0 tp -59.49 -32.63 70.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.375 -0.375 . . . . 74.22 111.036 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 12.8 t -92.75 -0.65 57.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.327 -0.397 . . . . 74.13 111.479 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.26 152.12 41.13 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.698 0.285 . . . . 62.54 110.871 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.48 162.61 15.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.296 -0.411 . . . . 74.3 111.107 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -61.38 119.42 8.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.924 -0.58 . . . . 74.21 111.144 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 76.03 17.79 79.82 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.99 -0.624 . . . . 73.32 113.042 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -96.72 145.99 25.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.873 0.368 . . . . 71.41 111.105 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt -117.33 136.88 52.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 73.43 110.01 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -149.77 176.12 10.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.033 0.444 . . . . 73.03 111.808 -179.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.11 136.27 36.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.691 -0.686 . . . . 75.41 109.572 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.443 ' CD2' ' CE1' ' A' ' 216' ' ' PHE . 1.4 pt? -140.25 140.42 35.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.141 0.496 . . . . 74.04 112.217 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.74 106.02 12.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.609 -0.723 . . . . 62.42 110.034 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.434 HD13 ' CZ ' ' A' ' 216' ' ' PHE . 4.2 mt -96.52 148.36 5.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.999 0.428 . . . . 60.12 111.582 -179.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.421 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.6 OUTLIER -81.69 167.51 30.76 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.765 -0.652 . . . . 71.13 110.477 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . 0.421 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 18.1 Cg_endo -60.1 -39.84 66.05 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.462 2.108 . . . . 74.33 112.222 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.12 -22.72 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.172 -0.467 . . . . 70.13 111.449 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . 0.426 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 8.9 m0 -118.03 37.01 4.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.687 0.28 . . . . 72.32 111.399 -179.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -155.43 -84.56 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.414 -0.357 . . . . 74.01 111.362 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.428 ' CE2' HG13 ' A' ' 208' ' ' ILE . 41.4 m-85 -106.0 -27.95 10.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.905 0.384 . . . . 75.21 110.828 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 107.28 178.9 22.55 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.846 -0.692 . . . . 71.33 112.836 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -59.61 -36.22 75.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.826 0.346 . . . . 74.44 110.892 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.6 -50.03 75.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 73.53 110.658 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.3 -153.38 17.25 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.86 -0.686 . . . . 70.05 112.595 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . 0.425 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 2.0 tm0? -152.15 84.26 4.9 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.837 0.351 . . . . 72.51 110.515 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -49.99 -44.43 37.34 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.762 2.308 . . . . 74.43 112.783 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.72 -42.12 71.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 65.24 111.012 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -96.43 27.37 3.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.031 -0.531 . . . . 61.24 111.29 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt 49.19 30.65 3.15 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.889 0.376 . . . . 61.33 111.057 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . 0.428 HG13 ' CE2' ' A' ' 198' ' ' TYR . 20.8 mm -94.8 111.75 55.49 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.098 -0.501 . . . . 73.43 111.188 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -69.95 171.04 15.4 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.405 2.07 . . . . 61.41 112.201 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.79 120.95 8.33 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.512 2.141 . . . . 74.24 112.228 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 63.4 70.38 0.53 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.173 -0.467 . . . . 72.3 110.859 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -122.42 154.7 37.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.183 -0.462 . . . . 72.42 111.336 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.42 149.43 22.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.019 -0.537 . . . . 71.53 110.448 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.422 HD13 ' CD2' ' A' ' 198' ' ' TYR . 9.0 mt -131.5 109.72 10.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.857 0.361 . . . . 75.22 111.313 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 1.4 m -110.11 140.49 44.13 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.057 -0.519 . . . . 74.32 110.779 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.631 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 23.2 p90 -155.92 -179.67 8.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.077 0.465 . . . . 75.14 111.374 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -132.89 136.61 46.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.72 -0.673 . . . . 73.43 110.256 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.8 t -120.99 150.31 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.018 0.437 . . . . 74.14 111.792 -178.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -136.23 108.51 7.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.809 -0.632 . . . . 74.02 110.27 179.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . 0.431 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 2.2 tt -70.05 129.55 39.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.332 -0.394 . . . . 64.1 110.91 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 29.6 t -105.99 -31.7 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.169 -0.469 . . . . 74.25 111.483 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -170.3 161.14 8.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.93 0.395 . . . . 74.31 111.219 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 38.4 mt -140.85 110.21 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.053 -0.521 . . . . 70.35 111.003 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 70.31 110.875 179.989 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 31.4 t . . . . . 0 CA--C 1.529 0.159 0 CA-C-O 120.577 0.227 . . . . 72.44 110.94 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -82.9 153.64 14.86 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.637 2.224 . . . . 71.51 112.607 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.402 ' NE2' ' CD1' ' A' ' 149' ' ' ILE . 3.0 tp60 -86.38 152.84 22.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 65.02 110.825 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.75 127.03 28.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 73.33 111.134 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -95.58 -31.43 13.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 62.5 110.892 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.452 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 3.0 m-90 -114.23 173.62 6.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.046 -0.525 . . . . 74.12 110.732 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 m -115.55 152.3 33.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.044 -0.526 . . . . 53.22 110.708 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.401 ' CG1' ' HD2' ' A' ' 16' ' ' ARG . 49.1 t -56.24 -34.01 38.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 71.42 110.691 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -73.34 -25.28 60.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.968 -0.56 . . . . 74.44 111.147 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -82.01 -56.55 3.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.821 0.343 . . . . 71.43 110.942 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 mt -49.49 -64.64 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 73.41 111.17 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.401 ' HD2' ' CG1' ' A' ' 12' ' ' VAL . 34.6 mtp85 -54.11 -25.0 19.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 72.31 111.229 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.96 176.62 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.0 0.429 . . . . 71.53 111.293 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -110.34 17.01 21.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.878 -0.601 . . . . 75.1 111.175 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -112.7 -23.45 10.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.554 -0.294 . . . . 73.32 111.222 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.452 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 10.2 tt -90.07 114.03 59.38 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.509 -0.314 . . . . 72.33 110.99 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -57.92 125.3 18.18 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.493 2.129 . . . . 74.34 112.303 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -24.19 67.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 74.0 111.245 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.5 mmtt -52.69 -35.16 54.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.397 . . . . 73.45 111.37 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.91 -56.59 4.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.283 -0.417 . . . . 73.15 111.109 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.425 HD11 HG22 ' A' ' 25' ' ' ILE . 40.4 mt -44.79 -32.86 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.896 -0.593 . . . . 75.12 111.474 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 9.4 mt -75.19 -41.72 44.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.964 0.412 . . . . 73.52 110.907 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -71.55 -25.02 62.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.874 -0.603 . . . . 74.42 111.116 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -70.03 -44.71 68.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.042 0.448 . . . . 62.12 110.761 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.7 mt -72.17 -21.42 61.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.728 -0.669 . . . . 73.32 111.101 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -83.87 -25.78 29.98 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.356 -0.384 . . . . 74.24 111.066 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.424 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -100.97 -1.01 35.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.422 -0.354 . . . . 70.52 111.512 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.424 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.9 m-70 -131.95 -6.47 3.53 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.697 0.258 . . . . 61.1 111.697 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.87 164.43 13.07 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.735 -0.745 . . . . 72.53 112.357 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 54.5 p -91.53 147.94 22.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.584 0.23 . . . . 72.21 110.553 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -48.16 -57.03 6.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.798 0.332 . . . . 72.22 110.991 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.9 m -48.67 -50.03 34.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.083 0.468 . . . . 74.51 110.574 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.479 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 36.5 t80 -53.6 -48.76 68.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.695 -0.684 . . . . 61.4 110.404 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 15.8 mt -65.01 -40.46 94.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.936 -0.575 . . . . 72.14 110.719 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.428 ' CB ' HD22 ' A' ' 44' ' ' LEU . . . -47.17 -47.68 23.89 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.046 0.45 . . . . 75.53 111.098 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -58.09 -26.14 62.2 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.72 -0.673 . . . . 64.4 110.842 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.445 ' O ' ' CG ' ' A' ' 42' ' ' LYS . 52.5 m-70 -112.4 10.57 19.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.265 -0.425 . . . . 74.1 111.239 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.445 ' CG ' ' O ' ' A' ' 41' ' ' HIS . 6.0 ptpt 49.18 35.28 7.08 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.954 0.406 . . . . 63.33 110.995 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 19.0 mt -93.51 -20.44 20.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.959 -0.564 . . . . 72.35 111.574 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.428 HD22 ' CB ' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -79.32 159.26 27.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.026 0.441 . . . . 71.32 111.147 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.56 -120.53 4.97 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 115.775 -0.648 . . . . 60.0 112.482 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -116.37 116.12 27.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.826 0.346 . . . . 74.31 110.878 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mp -45.83 -55.57 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.164 -0.471 . . . . 73.23 111.407 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.3 ptpt -46.95 -36.85 8.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.855 -0.611 . . . . 71.42 110.988 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -85.76 -25.47 26.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.939 -0.573 . . . . 72.22 111.067 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 28.3 t -83.09 -25.92 7.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.365 -0.379 . . . . 74.13 111.403 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.11 -16.29 63.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.426 -0.352 . . . . 74.14 111.474 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.32 -34.3 12.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.808 0.337 . . . . 62.41 110.895 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.4 t -86.95 -30.14 21.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.199 -0.455 . . . . 72.03 111.038 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.13 126.64 40.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 61.32 111.142 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -82.0 177.04 9.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 65.01 110.683 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -58.24 9.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.91 0.386 . . . . 75.44 110.541 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.17 -27.32 68.99 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.055 -0.52 . . . . 64.04 110.582 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.59 -40.61 95.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.067 -0.515 . . . . 70.41 110.399 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 20.3 mt -76.59 -31.12 57.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.743 -0.662 . . . . 75.42 110.936 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.7 t -77.75 -42.73 29.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.995 0.426 . . . . 74.01 110.68 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 53.6 m -60.51 -35.46 76.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.885 -0.598 . . . . 74.31 110.398 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.54 -22.06 44.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.981 -0.554 . . . . 61.4 110.823 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -83.69 -22.94 31.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.066 -0.516 . . . . 75.52 110.837 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -85.73 -53.74 4.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.17 0.509 . . . . 73.4 110.809 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.479 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 1.6 p-80 -59.97 -24.14 64.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.86 -0.609 . . . . 72.55 110.788 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.455 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 0.6 OUTLIER -44.93 -45.99 10.74 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.016 0.436 . . . . 73.01 110.521 179.641 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -79.28 -38.61 34.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.566 -0.743 . . . . 74.33 109.929 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -64.18 -16.24 61.52 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.739 -0.664 . . . . 70.01 111.246 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.86 -11.99 10.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.349 -0.387 . . . . 71.22 111.269 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 51.91 34.63 13.94 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.832 0.348 . . . . 74.35 110.987 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.455 ' CB ' ' CD1' ' A' ' 37' ' ' PHE . 91.6 mtt180 -98.4 46.45 1.0 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 74.23 110.91 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.415 ' CZ ' HD22 ' A' ' 66' ' ' LEU . 82.1 m-85 -71.15 -178.59 2.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.077 -0.511 . . . . 75.54 110.784 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.8 tttp . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.303 -0.408 . . . . 73.41 110.824 179.922 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.2 mttt . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.864 0.364 . . . . 74.32 110.949 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -167.29 151.68 6.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 71.14 110.864 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 26.0 m -113.74 129.94 56.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 71.25 110.296 179.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.93 144.14 51.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.973 0.416 . . . . 74.31 111.374 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -139.94 120.86 14.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.919 -0.582 . . . . 72.44 110.461 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 10.0 p -76.41 106.26 6.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.917 0.389 . . . . 64.42 111.191 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.6 mp -75.74 -75.38 0.18 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 74.45 110.87 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -96.97 107.94 20.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.154 -0.476 . . . . 74.21 110.9 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -58.68 126.29 27.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.166 -0.47 . . . . 73.32 110.937 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -86.26 -174.29 49.49 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.654 -0.784 . . . . 72.32 112.224 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -40.46 -40.95 1.32 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.828 0.347 . . . . 73.23 111.544 -179.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.8 tttp 73.4 43.15 0.38 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.461 . . . . 74.53 110.595 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.0 m -157.3 -45.41 0.07 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.899 -0.592 . . . . 73.31 110.55 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.14 97.55 10.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.07 -0.514 . . . . 72.31 110.692 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -111.11 156.12 41.47 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.078 -0.51 . . . . 74.31 110.834 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -68.61 125.6 12.96 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.514 2.143 . . . . 74.41 112.342 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.98 152.16 20.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 75.13 110.937 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -58.84 116.1 3.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 75.1 110.9 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 105.05 -21.92 34.61 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.705 -0.759 . . . . 73.42 112.669 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.3 138.99 31.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.845 0.355 . . . . 74.41 110.828 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.515 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 24.4 m -69.59 171.95 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 73.25 111.235 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.645 ' O ' ' HA ' ' A' ' 163' ' ' SER . 16.4 m -156.87 145.39 11.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.71 -0.677 . . . . 74.52 110.66 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.439 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.72 117.61 22.25 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.986 -0.285 . . . . 73.34 110.72 179.705 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . 0.407 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.3 p -153.67 171.44 18.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.004 0.43 . . . . 70.03 111.15 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.418 ' HB3' ' CD1' ' A' ' 149' ' ' ILE . 10.0 m95 -107.67 161.85 14.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.8 -0.637 . . . . 75.33 110.107 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.465 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 45.1 p90 -161.74 137.19 7.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.07 0.462 . . . . 75.34 111.917 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 5.4 m -126.72 112.38 15.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.661 -0.699 . . . . 73.35 110.646 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.581 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.67 142.57 16.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.603 -0.808 . . . . 61.45 112.976 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.58 143.87 28.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.8 0.333 . . . . 75.03 110.762 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 14.2 mt -83.22 -177.63 6.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 73.44 110.977 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -59.29 -43.22 92.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 72.04 110.906 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.81 -7.78 54.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.045 -0.525 . . . . 74.24 111.327 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 92.42 24.12 24.82 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.695 -0.764 . . . . 75.12 112.619 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.41 113.24 25.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.345 . . . . 71.21 110.777 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 8.3 p -63.64 130.95 29.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 74.11 111.162 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.417 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 36.2 p90 -108.95 -28.2 9.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.001 -0.545 . . . . 74.3 110.842 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -168.19 122.23 0.92 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.176 -0.465 . . . . 72.11 110.768 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 10.4 t -142.87 124.31 14.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.358 -0.383 . . . . 71.1 111.192 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . 0.465 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 29.9 t30 -91.86 40.85 1.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.082 -0.508 . . . . 72.1 110.804 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.418 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 6.7 mm . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.123 -0.489 . . . . 64.5 110.928 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.769 0.319 . . . . 71.31 111.097 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -146.38 134.38 10.6 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.255 -0.43 . . . . 74.45 110.837 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . 0.409 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 49.6 Cg_exo -55.37 156.4 17.41 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.446 2.097 . . . . 72.31 112.33 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 4.0 tt -74.67 122.96 24.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 74.42 110.429 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.645 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -100.26 121.2 41.09 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.03 0.443 . . . . 75.3 111.48 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . 0.443 ' CE1' ' CG2' ' A' ' 131' ' ' VAL . 7.3 p90 -149.71 140.97 23.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.88 -0.6 . . . . 75.22 110.571 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 72.3 mttt -77.48 136.7 38.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.038 0.447 . . . . 73.42 111.111 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.1 m -87.65 149.31 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.822 -0.627 . . . . 74.41 111.084 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.87 22.83 78.34 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.786 -0.721 . . . . 75.53 112.565 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 28.9 m -131.06 42.18 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.88 0.371 . . . . 73.43 111.044 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.25 38.57 6.6 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 121.137 -0.554 . . . . 74.54 113.062 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.34 -47.03 11.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.933 0.397 . . . . 74.12 110.852 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . 0.41 HG11 ' CE3' ' A' ' 175' ' ' TRP . 1.9 m -116.91 -179.94 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.943 -0.571 . . . . 75.21 110.913 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.521 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.88 161.44 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.414 -0.357 . . . . 74.42 111.297 -179.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 15.8 ttt85 -69.57 -26.68 64.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.195 -0.457 . . . . 73.13 110.998 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.11 -37.86 36.51 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.772 -0.727 . . . . 64.43 112.029 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.521 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 1.8 t90 -77.46 -32.9 54.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.024 0.44 . . . . 75.01 111.056 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.63 -35.47 80.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.802 -0.635 . . . . 73.43 110.479 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -75.97 -29.17 58.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 71.01 110.634 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -81.92 -54.44 5.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 65.14 111.125 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.435 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 14.5 mt -62.26 -18.92 62.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.883 -0.599 . . . . 75.54 111.186 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.8 tp -56.46 -23.91 42.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.344 -0.389 . . . . 73.41 111.452 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 16.5 p -112.94 18.13 18.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.596 -0.275 . . . . 71.15 111.585 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 182' ' ' MET . . . . . 0.4 ' HG3' HD23 ' A' ' 179' ' ' LEU . 7.4 mmm -77.06 95.18 4.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.831 0.348 . . . . 71.3 111.123 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.3 168.18 7.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 73.12 111.064 -179.699 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -62.81 113.23 2.92 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.873 -0.603 . . . . 63.32 110.949 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 84.98 0.96 88.99 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 120.854 -0.689 . . . . 70.42 112.91 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.58 137.94 44.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.923 0.392 . . . . 74.44 111.503 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.75 137.41 53.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.976 -0.556 . . . . 74.5 109.766 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -141.83 168.59 19.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.259 0.552 . . . . 72.44 112.132 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -137.78 101.01 4.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.391 -0.822 . . . . 63.15 109.766 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -123.66 149.48 45.39 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.067 0.461 . . . . 71.1 112.011 -178.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -119.37 117.1 27.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.605 -0.725 . . . . 71.12 110.247 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.424 HD12 ' CZ ' ' A' ' 216' ' ' PHE . 3.3 mp -98.33 137.85 24.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.969 0.414 . . . . 71.03 111.516 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.404 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.4 mt-10 -71.36 167.56 28.94 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.866 -0.607 . . . . 75.4 110.499 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . 0.404 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 20.8 Cg_endo -60.94 -41.65 43.21 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.391 2.061 . . . . 75.33 112.261 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -53.11 -26.82 17.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 71.42 111.405 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . . . . . . . . . 17.8 m0 -116.1 37.01 3.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.494 -0.321 . . . . 65.23 111.178 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -157.84 -82.3 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.348 -0.387 . . . . 72.41 111.641 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.447 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 14.2 m-85 -106.25 -32.9 7.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.907 0.384 . . . . 75.23 110.949 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 106.49 172.55 23.02 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.84 -0.695 . . . . 72.45 112.715 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 33.7 mtmt -61.59 -30.41 70.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.832 0.348 . . . . 73.14 110.902 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -56.16 -52.25 65.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 75.34 110.8 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 109.25 158.33 18.26 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.818 -0.706 . . . . 73.11 112.444 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . 0.419 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.9 OUTLIER -104.76 84.84 1.04 Allowed Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 120.771 0.32 . . . . 71.31 110.758 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.01 -20.15 57.43 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.591 2.194 . . . . 71.05 112.412 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -58.56 -41.89 86.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.368 -0.378 . . . . 65.32 110.891 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.5 28.38 8.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.102 -0.499 . . . . 75.33 111.26 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 7.9 tttt 58.43 54.42 5.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.937 0.399 . . . . 75.23 110.95 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . 0.436 HD12 ' CE2' ' A' ' 198' ' ' TYR . 33.9 mt -115.69 111.77 43.41 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 72.45 111.086 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.1 169.26 2.92 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.568 2.179 . . . . 71.11 112.398 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.27 128.01 12.49 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.636 2.224 . . . . 74.42 112.24 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 65.81 74.22 0.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.31 -0.404 . . . . 73.13 110.758 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.57 153.5 43.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.434 . . . . 74.01 111.365 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.12 139.16 30.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.011 -0.54 . . . . 75.22 110.367 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.447 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 5.8 mt -120.45 109.48 15.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.922 0.391 . . . . 73.1 111.441 -179.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 2.6 m -107.48 141.1 39.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.018 -0.537 . . . . 75.32 110.662 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.581 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 5.8 p90 -159.64 -177.7 6.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 74.52 111.177 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -138.71 141.86 38.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.899 -0.591 . . . . 74.34 110.552 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 23.5 t -121.55 152.43 25.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 70.42 112.01 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -135.5 106.0 6.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.707 -0.679 . . . . 75.02 110.356 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . 0.407 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.67 126.79 30.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.362 -0.381 . . . . 74.25 110.658 -179.774 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 21.2 t -108.06 -30.25 2.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.263 -0.426 . . . . 71.13 111.654 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -169.96 160.05 8.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.915 0.388 . . . . 63.53 111.183 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 3.5 mp -141.85 111.27 2.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.971 -0.559 . . . . 73.14 110.955 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.327 -0.397 . . . . 72.11 110.958 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 43.8 t . . . . . 0 CA--C 1.528 0.121 0 CA-C-O 120.62 0.248 . . . . 71.13 110.966 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.425 ' HG3' ' CG ' ' A' ' 32' ' ' HIS . 72.4 Cg_endo -77.62 136.99 15.89 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.638 2.226 . . . . 75.11 112.435 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 19.6 mm-40 -80.25 155.52 27.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 71.14 110.902 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.09 112.81 0.78 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.137 -0.483 . . . . 75.02 111.221 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.44 -14.78 32.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 73.22 111.414 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.447 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 1.3 m-90 -137.98 173.79 11.26 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.967 0.413 . . . . 74.3 110.814 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.2 m -115.43 149.83 37.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.988 -0.551 . . . . 74.31 110.713 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t -56.09 -31.33 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.926 0.393 . . . . 73.12 110.712 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -76.02 -25.96 56.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.871 -0.604 . . . . 70.11 111.004 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -82.11 -57.92 3.18 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.834 0.349 . . . . 71.43 110.813 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 mt -49.57 -63.09 1.21 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.222 -0.445 . . . . 73.2 110.948 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 25.4 mtt180 -53.99 -23.79 14.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.071 -0.513 . . . . 74.51 111.243 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.18 176.76 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.964 0.412 . . . . 75.24 111.121 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -110.34 16.8 21.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.95 -0.568 . . . . 75.31 111.158 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.41 -26.09 12.09 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.512 -0.313 . . . . 74.44 111.144 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.447 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 6.3 tt -91.97 111.55 50.45 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.39 -0.368 . . . . 70.41 111.016 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -55.88 130.01 38.04 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.378 2.052 . . . . 64.11 112.184 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.31 -24.09 67.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 75.24 111.127 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.5 mttt -49.78 -43.19 48.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.31 -0.404 . . . . 71.2 111.588 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -73.86 -54.79 7.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.936 0.398 . . . . 75.12 111.07 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.44 HG22 HD11 ' A' ' 25' ' ' ILE . 25.7 mt -45.36 -33.86 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.846 -0.615 . . . . 72.22 111.443 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 6.7 mt -76.79 -39.85 31.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.284 -0.416 . . . . 73.24 110.995 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.1 mttt -72.86 -25.61 61.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.036 -0.529 . . . . 73.44 111.009 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -69.74 -45.78 67.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.121 0.486 . . . . 74.14 110.719 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 mt -70.17 -25.58 63.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.608 -0.724 . . . . 75.15 111.115 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -74.38 -26.74 60.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.355 -0.384 . . . . 64.31 110.893 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.421 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 8.6 pt-20 -90.81 -39.05 12.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.346 -0.388 . . . . 73.23 110.706 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.425 ' CG ' ' HG3' ' A' ' 6' ' ' PRO . 35.8 m170 -98.54 16.63 21.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 72.21 110.964 179.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.61 153.32 23.02 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.829 -0.7 . . . . 62.42 112.571 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.57 154.47 19.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.651 0.263 . . . . 70.24 110.515 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -49.14 -56.97 7.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.76 0.315 . . . . 74.42 111.1 -179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -48.18 -50.23 29.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.033 0.444 . . . . 62.3 110.896 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.441 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 13.4 t80 -54.04 -47.73 71.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.795 -0.639 . . . . 72.11 110.493 179.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.42 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 13.3 mt -66.02 -41.39 91.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.062 -0.517 . . . . 71.23 110.777 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.428 ' CB ' HD21 ' A' ' 44' ' ' LEU . . . -48.07 -42.04 27.67 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.076 0.465 . . . . 73.4 110.827 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -49.55 -50.11 43.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.621 -0.718 . . . . 74.4 110.926 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -101.49 15.3 29.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.076 -0.511 . . . . 74.32 111.291 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 36.1 mttt 54.98 39.92 31.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.884 0.373 . . . . 73.53 111.05 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 17.0 mt -89.53 -22.18 22.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 73.23 111.487 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.428 HD21 ' CB ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.42 156.01 28.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.106 0.479 . . . . 74.23 111.171 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.72 -120.98 4.87 Favored Glycine 0 N--CA 1.451 -0.301 0 CA-C-N 115.641 -0.709 . . . . 74.12 112.379 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -116.39 115.2 25.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.771 0.32 . . . . 72.21 110.948 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mp -45.18 -58.37 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.186 -0.461 . . . . 74.32 111.397 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 mmtt -45.57 -36.96 5.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.782 -0.644 . . . . 75.33 111.049 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -85.77 -26.54 25.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.939 -0.573 . . . . 74.31 110.993 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 19.3 t -80.83 -26.03 10.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 74.02 111.417 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.64 -15.7 63.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.364 -0.38 . . . . 72.21 111.394 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.3 mtpt -95.17 -35.16 11.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.411 -0.359 . . . . 73.43 110.931 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 m -86.03 -22.42 27.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.173 -0.467 . . . . 64.42 111.318 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -107.95 136.76 47.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.467 -0.333 . . . . 72.22 111.19 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -93.27 -178.02 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 74.43 110.768 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -58.1 10.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.825 0.345 . . . . 73.43 110.981 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.32 -27.3 65.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.119 -0.491 . . . . 72.35 110.67 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -45.48 93.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.007 -0.542 . . . . 71.14 110.702 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 23.6 mt -73.31 -30.49 63.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.625 -0.716 . . . . 70.55 111.415 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 16.0 t -80.51 -43.67 21.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.989 0.424 . . . . 75.12 110.853 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.1 m -58.44 -35.87 72.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.881 -0.6 . . . . 73.43 110.583 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.71 -21.84 34.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.084 -0.507 . . . . 71.24 111.031 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -83.28 -22.96 32.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.298 -0.41 . . . . 73.22 111.162 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -83.07 -54.03 5.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.885 0.374 . . . . 74.13 111.43 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.433 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 4.4 p-80 -61.16 -34.08 74.45 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.495 . . . . 65.13 111.283 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.441 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.2 tt -46.42 -40.47 12.24 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.898 0.38 . . . . 74.03 111.201 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -78.98 -36.09 41.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.009 -0.541 . . . . 74.42 110.691 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -67.25 -39.85 86.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.058 -0.519 . . . . 72.24 110.873 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 71.5 p -94.87 -3.1 49.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.025 -0.534 . . . . 63.1 111.434 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 48.96 39.66 15.1 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.757 0.313 . . . . 73.32 111.38 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -93.52 43.66 1.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.384 -0.371 . . . . 73.34 111.034 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.432 ' CD2' HD22 ' A' ' 66' ' ' LEU . 88.5 m-85 -66.26 177.09 1.54 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.317 -0.401 . . . . 62.52 110.82 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.2 tttt . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.262 -0.426 . . . . 74.53 110.985 179.922 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.441 ' CB ' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 120.82 0.343 . . . . 75.25 110.687 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -166.53 150.52 7.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 74.14 110.858 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' THR . . . . . 0.427 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 77.0 m -112.23 133.02 54.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.126 -0.488 . . . . 75.32 110.346 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -130.88 148.32 52.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.953 0.406 . . . . 73.21 111.33 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -149.6 121.75 8.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.934 -0.576 . . . . 72.43 110.742 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 21.5 t -78.86 110.24 14.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.326 -0.397 . . . . 75.22 111.224 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -81.69 -46.62 14.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 74.41 110.926 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -124.32 108.12 11.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.438 . . . . 74.34 111.054 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.6 ttpm? -59.57 141.89 53.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 75.13 110.865 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.499 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -112.86 -156.11 12.35 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.738 -0.744 . . . . 74.32 112.605 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -36.05 -51.72 0.74 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.96 0.409 . . . . 64.52 111.527 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 69.03 33.82 3.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.926 -0.579 . . . . 71.13 110.307 -179.692 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 54.8 m -152.4 -44.61 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.76 -0.655 . . . . 60.43 110.698 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -88.94 91.13 8.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.481 . . . . 75.23 110.732 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -99.5 152.72 37.9 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 74.15 110.826 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -72.96 125.5 10.46 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.551 2.167 . . . . 73.51 112.495 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.4 mmtm -96.36 154.13 17.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.982 -0.554 . . . . 75.05 110.865 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.0 tptm -56.75 119.67 6.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.24 -0.437 . . . . 74.4 110.795 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 100.24 -22.72 38.81 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.626 -0.797 . . . . 72.44 112.366 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -81.54 137.63 35.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.745 0.307 . . . . 70.24 110.69 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.54 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 15.6 m -75.09 175.41 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.198 0.523 . . . . 75.43 111.767 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.598 ' O ' ' HA ' ' A' ' 163' ' ' SER . 22.3 m -157.75 147.0 9.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.342 -0.845 . . . . 74.2 110.557 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.453 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -125.21 117.27 23.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.701 0.286 . . . . 74.41 110.633 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . 0.422 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 32.1 p -154.2 167.25 30.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.87 0.367 . . . . 74.33 111.156 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.436 ' CE3' HG13 ' A' ' 149' ' ' ILE . 62.6 m95 -99.66 160.6 14.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.972 -0.558 . . . . 72.23 110.065 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 33.4 p90 -158.76 135.18 9.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.065 0.459 . . . . 75.23 111.584 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 54.3 m -126.74 111.59 14.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.658 -0.701 . . . . 64.24 110.417 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.545 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.78 142.9 16.35 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.604 -0.808 . . . . 75.31 113.07 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -149.34 138.95 21.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.761 0.315 . . . . 74.04 110.799 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 32.6 mt -72.81 -178.14 2.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.296 -0.411 . . . . 65.21 110.64 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -58.89 -42.59 89.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.987 0.422 . . . . 73.34 110.796 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.27 -7.67 55.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.942 -0.572 . . . . 72.44 111.368 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 94.7 25.77 14.61 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.648 -0.787 . . . . 63.02 112.582 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.27 108.38 18.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.8 0.333 . . . . 73.44 110.837 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 11.2 p -66.31 124.01 20.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.18 -0.463 . . . . 75.53 111.116 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.421 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 44.8 p90 -110.08 -21.28 12.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.155 -0.475 . . . . 73.33 111.095 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -157.02 127.94 6.73 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.857 0.361 . . . . 74.22 110.997 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 75.1 m -142.79 105.28 4.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 74.14 110.862 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -76.07 -6.52 51.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 73.42 111.323 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.476 ' CD1' ' N ' ' A' ' 149' ' ' ILE . 2.4 mp . . . . . 0 C--N 1.33 -0.263 0 CA-C-O 120.827 0.346 . . . . 64.14 111.0 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.779 0.323 . . . . 75.35 111.131 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.2 tttt -146.64 145.41 23.09 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 64.11 110.676 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.65 158.02 58.01 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.355 2.037 . . . . 73.33 112.239 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -80.04 127.87 32.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.126 -0.488 . . . . 72.12 110.845 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.598 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.8 OUTLIER -105.73 126.83 52.62 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.272 -0.422 . . . . 74.11 111.047 179.801 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 20.8 p90 -151.35 141.45 22.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 72.33 110.951 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 2.4 mtpt -69.62 130.81 43.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.305 -0.407 . . . . 71.43 110.909 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.3 m -87.77 149.32 4.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 63.33 111.057 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 69.04 24.22 75.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.729 -0.748 . . . . 74.21 112.577 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 15.4 m -134.09 46.43 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.915 0.388 . . . . 73.44 111.125 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.29 36.24 2.92 Favored Glycine 0 C--N 1.331 0.302 0 CA-C-N 116.101 -0.499 . . . . 50.4 113.295 179.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.43 -45.72 14.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.858 0.361 . . . . 74.42 111.089 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . 0.414 HG13 ' CE3' ' A' ' 175' ' ' TRP . 0.7 OUTLIER -119.26 -179.64 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.087 -0.506 . . . . 74.4 110.994 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.523 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -58.35 159.33 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.394 -0.367 . . . . 73.54 111.136 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 7.4 ttt85 -68.04 -27.23 66.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.254 -0.43 . . . . 73.13 111.191 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.3 -36.34 39.91 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.663 -0.78 . . . . 53.32 112.169 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.523 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.2 t90 -78.28 -33.62 49.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.909 0.385 . . . . 72.15 111.109 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -64.42 -38.26 90.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.088 -0.506 . . . . 55.2 110.489 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -73.5 -30.62 63.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.901 -0.59 . . . . 73.02 110.619 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -79.74 -55.96 4.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.496 . . . . 65.51 111.106 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.47 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 5.3 mt -59.69 -28.78 67.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.933 -0.576 . . . . 75.42 110.809 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.4 mt -60.42 -32.02 70.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.425 . . . . 74.32 110.789 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 63.9 p -92.41 2.45 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 73.14 111.407 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.24 150.04 37.09 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.741 0.305 . . . . 65.24 110.769 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.4 165.38 13.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 63.24 111.206 -179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.49 117.62 5.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.951 -0.568 . . . . 73.42 110.8 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.53 66.41 2.25 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.675 -0.774 . . . . 71.31 112.319 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . 0.499 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.8 tt0 -144.51 145.81 32.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.602 0.239 . . . . 73.12 110.389 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -117.55 134.72 54.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.688 0.28 . . . . 74.12 110.332 179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.29 168.0 20.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.113 0.482 . . . . 61.23 111.648 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.56 104.43 5.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.64 -0.709 . . . . 74.03 109.882 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.427 ' HA ' ' O ' ' A' ' 112' ' ' THR . 0.4 OUTLIER -126.52 147.18 49.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.081 0.467 . . . . 74.23 111.832 -179.069 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -117.07 125.17 50.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.689 -0.687 . . . . 72.43 110.438 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.416 HG12 ' CE2' ' A' ' 216' ' ' PHE . 2.4 mm -94.32 152.15 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.881 0.372 . . . . 74.32 111.221 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -87.06 159.11 51.95 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.052 -0.522 . . . . 70.12 110.657 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.37 -44.36 38.74 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.567 2.178 . . . . 71.43 112.228 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -56.34 -39.65 73.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.268 -0.424 . . . . 74.5 111.194 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . 0.441 ' CD2' ' CB ' ' A' ' 110' ' ' LYS . 9.9 m0 -97.37 36.95 1.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.324 -0.398 . . . . 72.23 110.99 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -164.64 -77.52 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.025 -0.534 . . . . 53.33 110.705 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.449 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 22.3 m-85 -102.85 -71.22 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 73.02 110.571 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 135.32 175.87 14.06 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.839 -0.696 . . . . 75.24 112.714 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 19.8 mtpt -58.34 -32.38 68.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.879 0.371 . . . . 74.44 110.884 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 11.1 mttm -59.83 -52.95 63.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 73.44 110.729 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 103.58 176.11 26.04 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.822 -0.704 . . . . 45.2 112.499 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . 0.421 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.4 OUTLIER -117.3 81.75 13.86 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.822 0.344 . . . . 75.11 110.791 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.12 -25.26 44.74 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.669 2.246 . . . . 65.41 112.46 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.25 -42.19 94.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.917 0.389 . . . . 64.12 111.04 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -103.82 29.81 5.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.114 -0.494 . . . . 73.25 111.212 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 39.8 mttt 56.09 28.03 12.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.258 -0.428 . . . . 73.2 111.075 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . 0.42 HD11 ' CE2' ' A' ' 198' ' ' TYR . 40.0 mt -91.38 111.67 50.15 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 73.43 110.992 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -74.0 173.92 13.25 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.491 2.127 . . . . 73.03 112.474 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -51.04 137.91 44.2 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.674 2.249 . . . . 72.24 112.255 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 5.9 p30 42.11 88.81 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.151 -0.477 . . . . 71.53 111.395 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.47 116.27 21.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.319 -0.4 . . . . 55.54 111.398 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 1.6 tptm -65.66 126.58 28.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 72.42 110.378 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.449 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 19.1 mt -104.47 109.52 21.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.342 -0.39 . . . . 72.15 111.44 -179.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 52.4 m -102.45 137.31 40.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 73.41 110.563 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.545 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 5.5 p90 -154.94 175.26 14.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.027 0.442 . . . . 75.25 111.331 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -133.01 136.77 46.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.645 . . . . 74.03 110.523 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.1 t -123.63 150.56 27.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.072 0.463 . . . . 64.32 111.891 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -136.81 111.07 8.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.744 -0.662 . . . . 74.4 110.225 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . 0.422 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 1.9 tt -69.93 129.28 39.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.831 0.348 . . . . 72.22 111.004 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 21.6 t -108.7 -29.32 2.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 64.54 111.421 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -170.66 161.34 7.49 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.91 0.386 . . . . 74.23 111.018 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 46.6 mt -139.79 110.43 4.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 74.15 111.051 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 74.54 110.952 179.966 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 43.0 t . . . . . 0 CA--C 1.529 0.15 0 CA-C-O 120.605 0.24 . . . . 73.34 111.055 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.434 ' HD2' ' CE2' ' A' ' 72' ' ' PHE . 95.1 Cg_endo -78.72 143.84 19.05 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.667 2.244 . . . . 75.54 112.408 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -81.67 151.34 27.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 64.35 110.774 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.57 113.99 0.95 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 74.23 111.182 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -88.07 -16.34 33.84 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.14 -0.482 . . . . 55.22 111.351 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.417 ' CH2' ' HB3' ' A' ' 24' ' ' ASP . 3.9 m-90 -136.34 173.63 11.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.836 0.35 . . . . 70.34 110.719 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.1 m -115.82 150.33 37.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.069 -0.514 . . . . 72.52 110.617 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t -56.3 -32.06 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.958 0.409 . . . . 74.41 110.772 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -77.01 -24.66 52.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.926 -0.579 . . . . 75.21 111.156 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -82.12 -57.25 3.48 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.851 0.358 . . . . 74.34 110.911 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mt -51.3 -60.31 3.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.253 -0.43 . . . . 74.24 111.012 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 21.7 mtt180 -57.51 -25.43 59.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.031 -0.531 . . . . 74.11 111.33 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.02 173.06 0.49 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.847 0.356 . . . . 72.32 110.983 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -99.78 16.18 24.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.095 -0.502 . . . . 74.12 111.207 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -112.31 -30.35 7.21 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.421 -0.354 . . . . 73.34 110.805 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.405 HD22 ' CD1' ' A' ' 10' ' ' TRP . 2.4 tm? -75.26 114.27 33.78 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 72.35 110.673 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -64.91 123.3 11.42 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.389 2.059 . . . . 71.1 112.488 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -26.52 68.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.04 -0.527 . . . . 75.23 111.254 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.2 ttmt -53.54 -37.02 62.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.877 0.37 . . . . 73.42 111.174 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.417 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 0.1 OUTLIER -74.41 -56.1 5.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 72.2 110.845 179.957 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.481 HD12 HG23 ' A' ' 25' ' ' ILE . 42.5 mt -44.89 -32.09 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.83 -0.623 . . . . 72.54 111.44 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.6 mt -76.66 -40.68 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 61.45 111.038 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -71.42 -24.91 62.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.893 -0.594 . . . . 73.14 111.21 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -72.36 -45.5 59.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.949 0.404 . . . . 75.42 110.886 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mt -68.41 -25.09 64.86 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.859 -0.609 . . . . 73.24 111.053 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -80.95 -24.44 38.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.31 -0.404 . . . . 72.14 111.177 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.419 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -101.26 -7.35 23.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.469 -0.332 . . . . 74.13 111.503 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.419 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.9 m-70 -125.78 -3.13 7.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.7 -0.227 . . . . 74.31 111.606 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.43 161.37 19.91 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.707 -0.758 . . . . 72.54 112.418 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -89.68 149.45 22.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.588 0.233 . . . . 63.15 110.61 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -49.1 -57.0 7.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.801 0.334 . . . . 73.21 111.075 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 14.5 m -47.24 -51.61 18.29 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.217 -0.447 . . . . 74.22 110.852 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.478 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 12.8 t80 -55.19 -44.3 75.19 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.857 -0.61 . . . . 74.44 110.323 179.56 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.417 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 13.4 mt -65.38 -42.4 92.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.015 -0.539 . . . . 73.43 110.665 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.409 ' CB ' HD23 ' A' ' 44' ' ' LEU . . . -46.48 -45.35 18.28 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.223 -0.444 . . . . 73.11 111.171 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.28 -25.74 64.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.857 -0.611 . . . . 74.21 110.859 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 67.0 m-70 -112.69 8.49 19.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.253 -0.43 . . . . 74.33 111.166 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt 54.38 33.7 19.14 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.804 0.335 . . . . 74.11 110.905 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.8 mt -92.39 -24.9 18.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 63.43 111.758 -179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.417 ' N ' ' HB3' ' A' ' 38' ' ' LEU . 0.3 OUTLIER -73.79 156.66 37.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.092 0.472 . . . . 74.21 111.185 -179.568 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.4 -122.75 5.7 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.671 -0.695 . . . . 70.43 112.378 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -116.31 119.48 35.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.787 0.327 . . . . 74.03 110.93 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mp -45.96 -53.22 2.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.224 -0.444 . . . . 75.35 111.337 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -47.93 -38.2 16.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.887 -0.597 . . . . 74.02 110.961 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -85.61 -25.57 26.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 75.53 111.059 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 26.3 t -81.86 -25.83 9.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.343 -0.389 . . . . 73.41 111.396 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.97 -17.13 63.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.384 -0.371 . . . . 73.55 111.438 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.2 pttt -95.19 -35.37 11.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.445 -0.343 . . . . 75.44 110.941 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.4 m -86.2 -23.38 26.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.202 -0.453 . . . . 72.04 111.105 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -101.97 125.9 48.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.373 -0.376 . . . . 75.14 111.161 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.29 175.28 10.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 74.33 110.559 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.1 -58.28 9.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.823 0.344 . . . . 74.12 110.51 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.86 -26.08 68.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.109 -0.496 . . . . 74.33 110.578 179.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.48 -43.21 99.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.114 -0.494 . . . . 74.53 110.341 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 20.8 mt -75.04 -30.11 60.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.631 -0.713 . . . . 72.4 110.998 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 14.0 t -79.14 -43.14 24.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.984 0.421 . . . . 73.32 110.759 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.9 m -60.27 -36.21 77.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.823 -0.626 . . . . 72.44 110.707 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -80.85 -22.31 40.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 75.22 111.0 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -83.76 -22.89 31.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.117 -0.492 . . . . 74.21 110.956 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -84.99 -54.35 4.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 75.34 111.342 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.466 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 2.5 p-80 -61.39 -24.49 66.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.06 -0.518 . . . . 75.45 111.179 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.478 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 3.9 tt -55.39 -39.33 70.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.937 0.399 . . . . 74.03 110.835 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -78.25 -38.82 41.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.025 -0.534 . . . . 71.33 110.705 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -37.46 78.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.013 -0.54 . . . . 74.34 111.002 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 45.4 p -90.02 -9.53 48.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.079 -0.509 . . . . 73.11 111.489 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.25 34.1 13.96 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.764 0.316 . . . . 75.54 111.186 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.5 mtt180 -93.63 45.18 1.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.289 -0.414 . . . . 74.22 111.048 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.453 ' CD2' HD21 ' A' ' 66' ' ' LEU . 89.9 m-85 -69.0 178.73 2.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.43 . . . . 75.32 110.824 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.3 tttt . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.229 -0.441 . . . . 72.51 110.872 179.909 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.42 ' HE2' ' CD1' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.807 0.337 . . . . 75.4 110.967 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 19.1 p90 -130.88 151.06 51.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 75.14 110.819 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 4.8 m -120.27 128.7 53.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.272 -0.422 . . . . 74.12 110.683 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -124.66 144.25 50.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.338 -0.392 . . . . 75.25 111.0 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.1 t -145.36 117.18 8.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 65.1 110.909 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 24.1 t -74.78 107.31 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 74.4 111.147 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -77.45 -53.93 7.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 74.13 111.005 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -120.68 108.19 13.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 74.52 111.096 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.75 149.63 21.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 74.2 110.87 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.519 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -121.88 -155.04 9.32 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.637 -0.792 . . . . 74.15 112.662 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -37.93 -53.4 1.34 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.964 0.411 . . . . 74.51 111.436 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.65 36.04 1.32 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.87 -0.604 . . . . 75.31 110.18 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 24.2 m -153.53 -44.09 0.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.645 -0.707 . . . . 74.52 110.663 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -92.82 96.71 10.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 62.54 110.819 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -108.76 151.27 41.67 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 74.32 110.893 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.04 125.59 19.7 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.517 2.145 . . . . 60.42 112.36 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -101.91 145.55 29.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.098 -0.501 . . . . 74.52 110.9 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -55.21 113.32 1.34 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.255 -0.429 . . . . 63.4 110.95 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.23 -19.61 48.05 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.644 -0.789 . . . . 73.03 112.577 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.59 138.22 31.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.8 0.333 . . . . 75.44 110.823 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.538 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 20.8 m -68.58 172.1 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.05 0.452 . . . . 73.25 111.415 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.687 ' O ' ' HA ' ' A' ' 163' ' ' SER . 19.5 m -156.75 144.36 10.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.612 -0.722 . . . . 74.43 110.19 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.481 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.76 117.85 22.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.759 0.314 . . . . 71.24 110.99 -179.85 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . 0.42 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 27.0 p -154.76 168.82 25.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.36 -0.382 . . . . 74.14 111.093 -179.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.421 ' CE3' HG13 ' A' ' 149' ' ' ILE . 75.5 m95 -102.18 161.58 13.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.057 -0.52 . . . . 64.43 110.129 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.431 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 14.1 p90 -159.27 135.05 8.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.042 0.449 . . . . 72.21 111.65 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.45 112.92 15.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.792 -0.64 . . . . 74.44 110.394 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.527 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.94 144.88 17.6 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.564 -0.827 . . . . 64.14 113.137 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -151.25 140.64 21.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.725 0.298 . . . . 65.15 110.473 179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 99.2 mt -78.09 -178.04 5.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.325 -0.398 . . . . 73.25 111.173 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -59.04 -42.89 91.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.969 -0.559 . . . . 74.13 110.857 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.31 -4.68 37.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.976 -0.556 . . . . 74.43 111.413 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.47 22.0 38.8 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.687 -0.768 . . . . 74.31 112.696 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.85 108.31 19.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.859 0.362 . . . . 74.44 110.683 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 m -68.33 130.33 33.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 73.1 111.247 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -110.95 -31.04 7.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 65.52 110.919 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -140.23 124.8 18.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 74.43 110.983 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 29.4 m -142.59 102.86 4.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 74.44 110.736 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . 0.431 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 45.3 t30 -76.15 -6.27 50.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 73.11 111.387 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.447 ' CD1' ' N ' ' A' ' 149' ' ' ILE . 2.6 mp . . . . . 0 C--N 1.33 -0.268 0 CA-C-O 120.844 0.354 . . . . 71.14 111.036 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.834 0.35 . . . . 73.31 111.083 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 17.9 mttt -146.42 109.16 4.19 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 73.33 110.917 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.63 150.37 12.18 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.442 2.095 . . . . 74.42 112.327 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 3.7 tt -74.21 119.28 18.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 75.31 110.631 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.687 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.45 122.1 42.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.885 0.374 . . . . 73.05 111.237 -179.813 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -151.52 143.1 23.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 74.43 110.874 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 64.3 mttt -78.0 138.28 38.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.037 0.446 . . . . 72.4 111.151 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.6 m -87.78 149.11 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.831 -0.622 . . . . 74.11 111.133 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.03 22.57 78.48 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.858 -0.687 . . . . 60.33 112.737 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 17.9 m -128.55 42.87 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.846 0.355 . . . . 63.44 111.172 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 40.48 38.19 1.39 Allowed Glycine 0 C--N 1.333 0.391 0 CA-C-N 116.013 -0.54 . . . . 74.31 113.461 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.64 -47.1 10.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.862 0.363 . . . . 74.41 111.131 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.9 m -112.04 -179.9 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.072 -0.513 . . . . 72.44 111.079 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.516 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -60.54 160.62 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.303 -0.408 . . . . 72.25 111.377 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -67.72 -25.83 65.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.1 -0.5 . . . . 75.35 111.285 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -80.31 -33.69 31.33 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.63 -0.795 . . . . 60.13 112.399 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.516 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.5 t90 -80.8 -35.69 32.68 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.071 0.397 . . . . 73.34 112.071 -179.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 7.0 p30 -73.04 -31.35 64.37 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.794 0.33 . . . . 72.44 110.277 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -74.59 -30.65 61.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 72.32 110.18 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -88.0 -45.25 10.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.012 -0.54 . . . . 61.12 111.132 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.477 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 4.8 mt -57.68 -38.7 75.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.13 -0.486 . . . . 74.2 110.607 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 16.5 mt -55.4 -24.19 28.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.124 -0.489 . . . . 74.4 110.937 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.0 -3.99 56.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.227 -0.442 . . . . 71.23 111.417 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.55 154.09 27.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.776 0.322 . . . . 72.5 110.623 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.08 171.52 8.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.977 0.418 . . . . 74.22 111.447 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -64.72 120.73 13.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.788 -0.642 . . . . 72.43 110.506 179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 67.85 63.8 3.49 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.543 -0.837 . . . . 64.35 112.19 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . 0.519 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 22.3 tt0 -144.57 147.03 32.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.633 0.254 . . . . 74.25 110.403 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -119.42 136.53 54.26 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.271 -0.27 . . . . 71.43 110.271 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.28 168.53 19.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.105 0.479 . . . . 54.44 111.811 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.66 101.01 4.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.589 -0.732 . . . . 74.31 109.874 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -118.92 145.33 45.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.069 0.462 . . . . 75.41 111.884 -178.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . 0.42 ' HA ' ' HA ' ' A' ' 215' ' ' THR . 16.2 pt-20 -118.14 116.21 26.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.625 -0.716 . . . . 74.23 110.248 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . . . . . . . . . 25.5 mt -106.89 128.7 61.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.279 -0.419 . . . . 64.44 111.589 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -61.65 164.9 8.42 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.902 -0.59 . . . . 74.22 110.615 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . 0.413 ' HG3' ' HA ' ' A' ' 211' ' ' ASN . 19.6 Cg_endo -58.68 -40.04 76.92 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.591 2.194 . . . . 64.31 112.291 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -53.54 -28.27 30.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 74.44 111.302 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . 0.42 ' CD1' ' HE2' ' A' ' 110' ' ' LYS . 13.8 m0 -110.24 35.3 3.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.845 0.355 . . . . 74.15 111.091 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -153.74 -79.93 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 74.23 111.071 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.4 ' CE2' HD11 ' A' ' 214' ' ' LEU . 19.3 m-85 -108.37 -33.69 7.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.405 . . . . 72.13 110.771 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 111.36 177.7 20.32 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.827 -0.701 . . . . 60.55 112.652 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -59.22 -36.32 75.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 74.45 110.838 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.13 -53.15 61.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 75.04 110.653 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 119.95 -151.81 17.25 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.943 -0.646 . . . . 73.12 112.494 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -143.98 78.14 14.16 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.905 0.383 . . . . 72.53 110.579 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -55.65 -21.7 32.79 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.599 2.2 . . . . 74.31 112.381 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.52 -42.12 99.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.419 -0.355 . . . . 75.12 110.955 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -111.9 22.68 14.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.188 -0.46 . . . . 72.04 111.356 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 21.5 mttp 58.52 54.46 5.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.916 0.389 . . . . 75.04 111.057 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . . . . . . . . . 23.0 mm -108.81 111.81 60.67 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 72.03 111.017 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.75 163.2 3.04 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.475 2.117 . . . . 73.32 112.447 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.04 128.72 13.37 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.634 2.222 . . . . 74.54 112.338 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . 0.413 ' HA ' ' HG3' ' A' ' 194' ' ' PRO . 22.8 m-80 62.6 66.99 0.73 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.249 -0.432 . . . . 74.54 110.908 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.87 129.74 51.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.264 -0.425 . . . . 74.44 111.539 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.4 143.95 57.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.942 -0.572 . . . . 74.11 110.469 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.4 HD11 ' CE2' ' A' ' 198' ' ' TYR . 9.6 mt -126.94 109.58 12.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.94 0.4 . . . . 75.24 111.779 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 215' ' ' THR . . . . . 0.42 ' HA ' ' HA ' ' A' ' 191' ' ' GLU . 2.7 m -107.67 138.05 44.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.974 -0.557 . . . . 75.21 110.436 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.527 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 22.7 p90 -152.41 175.31 12.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.094 0.473 . . . . 73.1 111.542 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -130.28 134.1 46.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.734 -0.666 . . . . 74.01 110.432 179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . 0.403 HG11 ' N ' ' A' ' 219' ' ' GLU . 5.8 t -121.73 150.43 25.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.997 0.427 . . . . 74.31 111.898 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . 0.403 ' N ' HG11 ' A' ' 218' ' ' VAL . 14.7 tt0 -136.94 109.22 7.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.762 -0.654 . . . . 75.13 110.233 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . 0.42 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 1.9 tt -70.06 133.25 47.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.504 -0.316 . . . . 65.41 110.975 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 21.9 t -112.62 -29.53 2.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.238 -0.437 . . . . 72.32 111.451 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . 0.419 ' HB3' ' CD2' ' A' ' 132' ' ' HIS . 9.4 t70 -169.03 158.59 8.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.907 0.384 . . . . 74.32 111.157 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 30.7 mt -141.52 111.53 3.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.109 -0.496 . . . . 74.31 111.182 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 33.8 t70 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.245 -0.434 . . . . 63.52 110.871 179.884 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.4 ' CG1' ' CG2' ' A' ' 136' ' ' THR . 29.9 t . . . . . 0 CA--C 1.529 0.138 0 CA-C-O 120.558 0.218 . . . . 75.13 111.103 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -79.68 142.53 16.16 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.65 2.234 . . . . 62.1 112.449 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -78.54 147.91 33.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.244 -0.435 . . . . 74.51 110.785 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.97 96.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.213 -0.449 . . . . 74.22 111.285 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.99 -15.62 63.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 72.41 111.379 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.468 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 2.0 m-90 -135.64 173.79 11.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.907 0.384 . . . . 73.31 110.794 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -117.0 153.26 32.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.978 -0.555 . . . . 73.01 110.517 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.7 t -56.31 -34.05 39.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.396 . . . . 74.45 110.975 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -72.8 -25.67 61.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.532 . . . . 73.15 111.197 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -82.15 -56.57 3.85 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.821 0.343 . . . . 75.23 111.122 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.0 mt -49.55 -64.36 0.83 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.284 -0.417 . . . . 74.13 111.123 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -54.45 -25.46 25.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.5 . . . . 73.34 111.345 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.13 173.24 0.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.023 0.44 . . . . 73.43 111.31 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -108.25 16.99 22.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.766 -0.652 . . . . 75.23 110.945 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -107.75 -23.61 12.02 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.386 -0.37 . . . . 74.41 111.065 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.468 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 10.0 tt -93.17 116.19 66.12 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.407 -0.36 . . . . 74.32 111.029 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -57.2 126.6 22.61 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.478 2.118 . . . . 74.12 112.198 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -24.11 67.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 72.43 111.203 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.4 mmtt -53.74 -36.87 62.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.375 -0.375 . . . . 74.45 111.292 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -72.67 -57.22 4.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.266 -0.425 . . . . 73.51 111.021 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.47 HD13 HG21 ' A' ' 25' ' ' ILE . 36.5 mt -44.77 -30.56 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.892 -0.594 . . . . 71.23 111.466 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.7 mt -78.08 -38.83 24.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.931 0.396 . . . . 75.52 111.03 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 mtpt -73.78 -24.9 59.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.96 -0.564 . . . . 74.41 111.131 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -72.96 -45.19 59.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.923 0.392 . . . . 75.52 110.842 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.2 mt -69.27 -24.53 63.98 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.911 -0.586 . . . . 75.22 111.033 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -80.0 -26.89 39.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.407 . . . . 63.54 111.112 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.427 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -101.8 -1.3 32.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.415 -0.357 . . . . 71.34 111.593 -179.889 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.427 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.7 m-70 -132.6 -10.9 3.14 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.857 0.317 . . . . 74.54 111.857 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.86 105.49 0.81 Allowed Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.603 -0.808 . . . . 65.32 112.372 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -31.94 152.48 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.544 0.572 . . . . 63.45 112.544 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -50.09 -56.8 9.41 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.692 -0.685 . . . . 71.21 111.292 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.52 -49.96 17.82 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.032 0.444 . . . . 71.42 110.77 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.447 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 2.4 t80 -52.99 -47.26 68.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.786 -0.643 . . . . 74.1 110.321 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.416 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 12.1 mt -66.86 -41.48 87.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.938 -0.574 . . . . 74.32 110.853 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.64 -41.84 32.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.093 0.473 . . . . 52.12 110.75 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -49.4 -48.28 47.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.678 -0.692 . . . . 72.33 110.93 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.418 ' CD2' ' N ' ' A' ' 41' ' ' HIS . 2.9 m-70 -103.89 14.86 29.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.042 -0.526 . . . . 74.34 111.201 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 4.8 mtmm 55.51 42.14 30.09 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.889 0.376 . . . . 71.54 111.1 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 20.3 mt -93.24 -19.43 21.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 72.44 111.532 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.416 ' N ' ' HB3' ' A' ' 38' ' ' LEU . 0.3 OUTLIER -79.73 157.81 27.07 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.04 0.448 . . . . 75.43 111.077 -179.863 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.73 -121.55 5.13 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.747 -0.661 . . . . 51.13 112.379 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -116.36 116.88 28.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.773 0.321 . . . . 72.5 110.92 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mp -45.9 -54.72 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.237 -0.438 . . . . 73.32 111.33 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -47.09 -36.75 8.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 74.51 110.849 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -85.67 -26.03 26.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.93 -0.577 . . . . 73.42 110.959 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 22.8 t -79.8 -26.03 12.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.293 -0.412 . . . . 72.11 111.353 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.61 -23.13 66.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 70.24 111.126 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.21 -30.43 14.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 72.2 110.758 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.2 m -98.2 33.74 2.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 62.14 111.053 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -165.4 135.05 3.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 63.25 111.027 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -94.03 177.33 6.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 74.11 110.964 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.04 -57.79 10.63 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.26 -0.427 . . . . 73.24 111.053 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -58.73 -28.31 65.73 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 70.33 110.577 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.27 -47.25 85.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.957 -0.565 . . . . 60.44 110.905 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.7 mt -73.9 -30.94 62.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.654 -0.703 . . . . 74.41 111.283 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 22.3 t -78.84 -43.23 25.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.986 0.422 . . . . 73.34 111.007 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 96.6 m -60.48 -37.84 82.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.945 -0.571 . . . . 72.41 110.71 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.441 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -78.21 -23.41 47.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 63.33 111.081 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -83.96 -53.52 5.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.148 0.499 . . . . 71.14 110.656 179.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -50.56 -57.01 9.15 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.514 -0.766 . . . . 73.24 111.371 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.441 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 3.0 p-80 -63.47 -24.86 68.01 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.155 -0.475 . . . . 74.43 111.193 -179.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.449 HD23 ' CD2' ' A' ' 72' ' ' PHE . 3.7 tt -51.95 -41.39 62.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.907 0.384 . . . . 64.41 110.891 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -79.04 -40.09 32.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.975 -0.557 . . . . 73.25 110.553 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -62.39 -45.19 94.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.979 -0.555 . . . . 71.1 110.676 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 72.7 p -90.75 -1.99 57.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.93 -0.577 . . . . 64.23 111.346 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.1 pttt 45.06 42.16 6.24 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.794 0.331 . . . . 74.31 111.554 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -92.11 47.24 1.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 73.25 110.884 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.449 ' CD2' HD23 ' A' ' 66' ' ' LEU . 87.3 m-85 -73.05 -175.0 1.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 75.44 110.924 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.6 tttt . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.415 . . . . 75.41 110.857 179.907 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.416 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.795 0.331 . . . . 75.4 110.962 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.423 ' CE1' ' HB3' ' A' ' 178' ' ' ALA . 47.3 p90 -151.98 163.73 38.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 74.15 110.852 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' THR . . . . . 0.42 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 64.1 m -130.2 103.57 6.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 73.55 110.939 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.46 146.42 34.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 75.21 110.897 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 2.1 m -142.23 125.75 16.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 74.43 110.925 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 41.8 t -72.68 106.11 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 75.24 111.451 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.8 mp -75.62 -60.71 2.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 73.32 110.484 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.0 ttpp -111.62 108.07 17.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.954 -0.566 . . . . 73.44 110.64 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.4 mtpt -60.21 137.37 58.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.26 -0.427 . . . . 72.35 111.024 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -104.19 -106.01 3.05 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.762 -0.733 . . . . 61.33 112.198 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.22 -43.94 11.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.958 0.408 . . . . 75.44 110.589 179.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 71.05 36.44 1.42 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.909 -0.587 . . . . 73.52 110.679 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 60.1 m -163.97 -43.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.017 -0.538 . . . . 74.41 110.768 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.35 91.72 6.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 73.21 110.952 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -103.34 149.89 37.43 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.129 -0.487 . . . . 74.43 110.906 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.14 125.66 10.5 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.597 2.198 . . . . 75.03 112.387 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.91 159.38 15.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 72.55 110.8 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.53 118.45 5.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.343 -0.39 . . . . 74.52 110.965 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 103.0 -17.72 51.6 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.762 -0.732 . . . . 41.24 112.499 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.41 133.35 35.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.902 0.382 . . . . 74.23 110.903 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.42 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 5.7 p -69.96 162.8 3.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.506 . . . . 63.13 110.848 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.604 ' O ' ' HA ' ' A' ' 163' ' ' SER . 5.4 m -153.16 144.85 15.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.206 -0.452 . . . . 62.33 111.048 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.465 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.48 117.8 22.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.768 0.318 . . . . 74.34 110.725 179.68 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . 0.452 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.1 p -154.76 168.87 25.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.901 0.381 . . . . 73.33 111.067 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -102.91 162.62 12.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.012 -0.54 . . . . 74.33 110.195 179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.41 ' CE1' HD12 ' A' ' 162' ' ' LEU . 33.2 p90 -159.93 135.2 8.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.982 0.42 . . . . 74.13 111.458 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.4 ' CG2' ' CG1' ' A' ' 5' ' ' VAL . 6.8 m -129.32 115.38 17.5 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.847 -0.615 . . . . 74.15 110.337 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.564 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.82 144.26 17.15 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.619 -0.8 . . . . 74.02 113.108 -179.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -148.11 145.98 28.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.784 0.326 . . . . 74.22 110.548 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 21.9 mt -82.27 -177.97 6.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.277 -0.42 . . . . 64.24 111.159 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -57.63 -42.48 83.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 72.32 110.937 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.94 -5.4 46.0 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.016 -0.538 . . . . 63.14 111.405 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.64 25.84 26.64 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.64 -0.79 . . . . 73.53 112.546 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -95.35 112.2 23.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.339 . . . . 75.41 110.771 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . 0.415 ' HA ' ' O ' ' A' ' 137' ' ' GLY . 2.5 m -63.6 144.15 14.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.436 . . . . 73.52 111.17 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.422 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 42.2 p90 -120.92 -36.56 3.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 73.53 111.284 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . 0.414 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 59.7 m-20 -158.07 118.04 3.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.906 0.384 . . . . 71.21 111.355 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 14.7 t -142.94 129.46 20.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.514 . . . . 74.11 110.491 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . 0.408 ' OD1' ' CD1' ' A' ' 135' ' ' TYR . 19.8 p-10 -96.22 39.32 1.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.8 0.333 . . . . 74.33 111.1 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.425 ' CD1' ' N ' ' A' ' 149' ' ' ILE . 2.7 mp . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 74.31 110.713 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.78 0.324 . . . . 65.21 111.04 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -136.83 138.4 26.01 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 73.45 110.904 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.76 151.62 31.6 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.384 2.056 . . . . 72.41 112.359 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.41 HD12 ' CE1' ' A' ' 135' ' ' TYR . 4.6 tt -76.08 119.95 20.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 73.23 110.572 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.604 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -98.68 122.17 41.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.907 0.384 . . . . 72.51 111.273 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . 0.424 ' CE1' ' CG2' ' A' ' 131' ' ' VAL . 8.4 p90 -151.62 143.55 23.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.014 -0.539 . . . . 75.1 110.724 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 14.7 mtmm -80.92 139.11 36.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.082 0.468 . . . . 74.42 111.129 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.1 m -87.46 149.46 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.71 -0.677 . . . . 72.31 111.44 -179.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.51 22.54 77.84 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.82 -0.627 . . . . 64.14 112.768 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 17.1 m -129.38 42.29 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 75.42 111.096 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.69 37.47 5.14 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 121.143 -0.551 . . . . 73.22 113.088 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -86.02 -36.8 19.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.819 0.342 . . . . 74.52 111.131 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.6 m -126.76 179.39 3.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.457 . . . . 72.21 111.19 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.51 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -60.57 159.45 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 73.32 111.301 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -67.41 -27.8 67.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 74.41 111.199 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.96 -36.97 39.75 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.662 -0.78 . . . . 74.04 112.059 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.512 ' CD1' ' HG ' ' A' ' 179' ' ' LEU . 2.4 t90 -78.3 -34.15 48.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.957 0.408 . . . . 74.4 111.113 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.78 -32.21 73.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.948 -0.569 . . . . 62.34 110.675 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -79.06 -29.82 43.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.48 . . . . 73.13 110.837 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . 0.423 ' HB3' ' CE1' ' A' ' 111' ' ' TYR . . . -82.58 -52.38 6.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.234 -0.439 . . . . 75.44 111.181 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.512 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 10.2 mt -58.4 -34.89 71.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.988 -0.551 . . . . 73.22 110.842 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.6 mp -53.68 -37.62 63.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 72.2 111.084 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 39.2 p -84.18 1.99 41.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.037 -0.529 . . . . 73.03 111.518 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.15 151.38 33.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.765 0.317 . . . . 73.42 110.863 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.72 165.76 11.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.291 -0.413 . . . . 71.42 110.938 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.89 124.97 23.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.08 -0.509 . . . . 74.15 111.021 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 67.8 44.15 81.25 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.84 -0.695 . . . . 74.44 112.841 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . 0.4 ' HG2' ' N ' ' A' ' 187' ' ' LYS . 13.4 tt0 -126.91 149.94 49.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.581 0.229 . . . . 61.44 110.528 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . 0.4 ' N ' ' HG2' ' A' ' 186' ' ' GLU . 4.7 ttmt -117.95 138.17 52.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.098 -0.334 . . . . 72.32 110.098 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -148.23 175.85 10.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.075 0.464 . . . . 61.21 111.846 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.13 133.6 33.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.607 -0.724 . . . . 71.43 109.584 178.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.423 ' HG ' ' CE1' ' A' ' 216' ' ' PHE . 1.1 pt? -140.34 141.18 35.69 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.158 0.504 . . . . 73.53 112.045 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.68 110.36 18.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.587 -0.733 . . . . 72.34 110.257 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.449 ' CD1' ' CE2' ' A' ' 216' ' ' PHE . 2.1 mp -96.25 139.44 19.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.916 0.389 . . . . 74.12 111.344 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -73.64 166.38 44.69 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.945 -0.57 . . . . 74.35 110.964 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.56 -14.34 41.87 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.676 2.25 . . . . 73.44 112.608 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -80.38 -30.01 37.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.814 0.34 . . . . 72.43 111.028 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . 0.416 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 15.3 m0 -111.06 36.9 2.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.29 -0.413 . . . . 71.33 111.004 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -153.16 -78.4 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.256 -0.429 . . . . 74.52 111.018 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.44 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 24.0 m-85 -106.92 -71.17 0.76 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 71.13 110.792 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 145.74 176.04 19.32 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.83 -0.7 . . . . 51.43 112.596 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -57.5 -25.58 60.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.728 0.299 . . . . 72.22 111.005 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -74.68 -52.02 12.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.998 0.427 . . . . 74.25 110.863 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.78 174.01 24.67 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.854 -0.689 . . . . 54.21 112.533 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . 0.415 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.0 OUTLIER -106.32 91.27 5.54 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.66 0.267 . . . . 75.1 110.845 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.22 -21.61 54.84 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.509 2.139 . . . . 74.01 112.445 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.39 -41.84 94.65 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.383 -0.371 . . . . 71.11 110.932 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -105.96 30.0 6.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 72.32 111.126 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 21.6 mttp 56.8 29.43 16.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 73.15 111.044 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . 0.423 HD11 ' CE2' ' A' ' 198' ' ' TYR . 30.3 mt -91.11 111.77 50.3 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.304 -0.407 . . . . 64.24 111.013 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -68.55 171.23 13.43 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.461 2.107 . . . . 73.44 112.401 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -67.01 145.84 75.16 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.587 2.191 . . . . 74.41 112.253 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 48.92 73.61 0.22 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.255 -0.429 . . . . 71.25 111.152 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -127.37 113.66 16.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.312 -0.404 . . . . 53.45 111.479 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.08 116.5 6.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.054 -0.521 . . . . 74.04 110.44 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.44 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 11.1 mt -93.46 109.87 21.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.162 -0.472 . . . . 63.14 111.568 -179.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 96.4 m -107.43 138.13 44.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.935 -0.575 . . . . 65.15 110.303 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.564 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 14.9 p90 -155.33 179.38 9.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.082 0.467 . . . . 75.13 111.552 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -133.48 136.85 45.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.686 -0.688 . . . . 75.31 110.748 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.0 t -121.8 151.21 25.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.168 -0.469 . . . . 53.5 111.756 -179.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -136.74 108.78 7.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.793 -0.639 . . . . 71.22 110.365 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . 0.452 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 0.7 OUTLIER -69.83 128.56 36.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.364 -0.38 . . . . 74.22 110.829 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 39.3 t -108.7 -30.05 2.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.25 -0.432 . . . . 75.45 111.023 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -167.14 156.81 10.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.354 -0.384 . . . . 72.42 110.948 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 4.4 mp -142.75 112.35 2.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.239 -0.437 . . . . 75.43 111.097 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 73.52 110.89 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.4 ' CG1' ' CG2' ' A' ' 136' ' ' THR . 44.7 t . . . . . 0 CA--C 1.529 0.138 0 CA-C-O 120.634 0.254 . . . . 72.12 110.951 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.443 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 80.3 Cg_endo -78.56 141.96 18.0 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.713 2.275 . . . . 70.14 112.473 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -79.91 149.35 30.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.126 -0.488 . . . . 73.45 110.975 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.406 ' HG3' ' CE2' ' A' ' 67' ' ' PHE . 0.0 OUTLIER -49.86 116.61 1.88 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 74.13 111.162 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.29 -13.9 34.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.146 -0.479 . . . . 74.11 111.576 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.45 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 2.0 m-90 -137.94 173.73 11.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.961 0.41 . . . . 73.41 110.966 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 m -117.51 151.8 36.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.944 -0.571 . . . . 71.2 110.741 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.8 t -56.7 -33.09 39.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.948 0.404 . . . . 64.55 110.824 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -75.4 -25.61 57.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.949 -0.568 . . . . 75.32 111.017 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -82.12 -57.45 3.39 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.831 0.348 . . . . 74.14 110.929 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -49.7 -62.98 1.25 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.241 -0.436 . . . . 73.5 111.006 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 17.9 mtt180 -54.07 -24.09 16.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.087 -0.506 . . . . 70.22 111.291 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.31 176.84 0.11 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.891 0.377 . . . . 72.41 111.168 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -110.38 16.81 21.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.98 -0.554 . . . . 72.55 111.194 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -108.9 -24.81 11.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.521 -0.309 . . . . 75.43 111.165 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.45 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 1.8 tt -90.95 111.69 49.59 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.388 -0.369 . . . . 75.4 111.03 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -55.97 128.09 28.8 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.448 2.099 . . . . 75.22 112.211 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -24.16 67.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 73.32 111.222 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.04 -41.62 62.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.425 -0.352 . . . . 75.3 111.472 -179.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.95 -57.34 4.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.197 -0.456 . . . . 53.21 111.104 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 4.9 mt -44.96 -30.49 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.858 -0.61 . . . . 70.4 111.613 -179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.5 mt -77.74 -37.85 24.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.938 0.399 . . . . 73.34 110.969 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -73.11 -23.75 60.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.062 -0.517 . . . . 75.1 111.03 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.452 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 34.6 t80 -73.22 -47.02 46.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.06 0.457 . . . . 75.21 110.99 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 mt -69.11 -27.77 65.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.782 -0.645 . . . . 74.23 111.136 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -75.69 -29.26 58.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.405 . . . . 72.41 110.987 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -93.34 -39.65 10.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 71.21 111.113 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.452 ' ND1' ' CZ ' ' A' ' 28' ' ' PHE . 18.3 m170 -90.27 -5.0 56.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.294 -0.412 . . . . 64.41 111.448 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.01 161.94 15.96 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.712 -0.756 . . . . 70.45 112.425 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.81 153.38 18.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.62 0.248 . . . . 72.13 110.501 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -48.83 -56.97 7.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.77 0.319 . . . . 74.42 111.066 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.14 -51.24 25.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.053 0.454 . . . . 71.24 110.803 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.508 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 16.5 t80 -53.07 -48.09 67.98 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.803 -0.635 . . . . 71.53 110.453 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 13.3 mt -66.18 -40.67 90.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.055 -0.521 . . . . 74.53 110.775 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.432 ' CB ' HD22 ' A' ' 44' ' ' LEU . . . -47.65 -48.19 28.96 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.03 0.443 . . . . 62.13 111.1 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -57.33 -26.68 61.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.713 -0.676 . . . . 70.43 110.94 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.406 ' NE2' ' CE1' ' A' ' 65' ' ' HIS . 67.8 m-70 -112.57 11.07 19.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.283 -0.417 . . . . 74.54 111.248 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.89 34.79 11.0 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.817 0.341 . . . . 75.14 110.901 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 23.2 mt -93.29 -20.65 20.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 74.13 111.736 -179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.432 HD22 ' CB ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.39 158.89 27.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.031 0.443 . . . . 72.42 111.102 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.61 -119.6 4.64 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.775 -0.648 . . . . 51.53 112.453 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.4 115.16 25.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.803 0.335 . . . . 72.41 110.891 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mp -45.41 -57.66 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.164 -0.471 . . . . 75.21 111.499 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -45.68 -37.25 5.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.804 -0.634 . . . . 74.43 111.076 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -85.75 -25.92 26.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.566 . . . . 71.31 111.086 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 19.2 t -81.14 -26.36 10.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.304 -0.407 . . . . 73.11 111.459 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.99 -18.02 64.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.403 -0.362 . . . . 74.24 111.365 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -95.2 -34.53 12.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.42 -0.355 . . . . 73.43 111.076 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.46 -19.74 35.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 74.22 111.409 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -116.16 139.26 50.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 74.35 111.255 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -91.42 -177.47 4.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.151 -0.477 . . . . 74.13 110.74 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.1 mmmt -59.59 -58.02 10.42 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.457 -0.338 . . . . 73.05 110.91 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.94 -27.87 65.73 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.205 -0.452 . . . . 74.44 110.625 179.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.77 -43.11 99.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.958 -0.564 . . . . 73.31 110.756 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 29.1 mt -76.35 -28.85 56.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.687 -0.688 . . . . 75.1 111.196 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 18.2 t -80.42 -43.93 21.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.001 0.429 . . . . 72.44 110.685 179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 72.4 m -59.29 -33.98 71.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.88 -0.6 . . . . 72.22 110.457 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -83.23 -21.97 33.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 71.31 110.942 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -83.64 -22.84 32.05 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.171 -0.468 . . . . 75.31 111.113 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -84.56 -53.9 5.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.074 0.464 . . . . 70.04 111.321 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.508 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.9 p-80 -60.43 -29.23 68.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.003 -0.544 . . . . 74.23 111.022 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.457 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.5 tt -46.73 -42.09 16.17 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.877 0.37 . . . . 71.33 110.985 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.406 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 5.8 m-85 -78.14 -41.08 36.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.997 -0.547 . . . . 70.42 110.276 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -70.31 -13.02 61.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.899 -0.592 . . . . 75.1 111.02 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.444 ' N ' ' O ' ' A' ' 65' ' ' HIS . 39.3 p -110.6 -16.16 13.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.267 -0.424 . . . . 75.53 111.259 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.9 mtmm 57.41 29.95 17.79 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.784 0.326 . . . . 73.32 111.043 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.1 mtt85 -95.1 44.07 1.09 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 71.45 110.993 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.442 ' CD2' HD21 ' A' ' 66' ' ' LEU . 61.5 m-85 -66.29 174.63 2.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 74.14 110.758 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.293 -0.412 . . . . 75.34 110.856 179.974 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.424 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.789 0.328 . . . . 72.15 110.97 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 6.2 p90 -160.99 -171.89 3.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 74.2 110.809 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 18.7 m -156.44 103.71 2.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 75.41 111.282 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.3 tttt -100.45 150.99 22.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.202 -0.454 . . . . 73.11 110.66 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 65.6 m -145.49 123.11 11.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.35 -0.386 . . . . 72.43 111.037 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 32.7 t -80.77 106.36 11.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 65.24 111.187 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -82.27 -41.56 20.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.448 . . . . 74.1 110.683 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 8.3 tptt -125.29 108.08 11.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 73.45 110.825 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.0 mtmp? -62.1 139.27 58.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 70.32 110.945 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -110.96 -158.48 15.54 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.719 -0.753 . . . . 70.4 112.408 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -35.88 -49.21 0.61 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.913 0.387 . . . . 75.32 111.708 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 tmtt? 72.89 37.71 0.79 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.994 -0.548 . . . . 75.5 110.298 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -164.43 -44.05 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.729 -0.669 . . . . 63.21 110.55 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -84.82 91.7 8.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.066 -0.515 . . . . 74.24 110.671 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -108.89 154.98 41.55 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.466 . . . . 72.42 110.885 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -73.58 125.63 10.23 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.546 2.164 . . . . 74.13 112.407 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.07 157.37 15.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 71.01 110.891 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.0 115.36 3.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 73.41 110.958 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 108.02 -24.02 24.11 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.732 -0.747 . . . . 71.15 112.568 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -84.54 135.27 34.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 63.13 110.797 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.48 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 22.7 m -68.21 171.69 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.29 -0.414 . . . . 72.42 111.191 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.65 ' O ' ' HA ' ' A' ' 163' ' ' SER . 10.9 m -156.13 145.31 12.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.863 -0.608 . . . . 74.22 110.593 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.437 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.3 OUTLIER -127.6 117.59 22.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.702 0.286 . . . . 75.21 110.818 179.595 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . 0.412 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 30.1 p -153.47 169.09 24.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.965 0.412 . . . . 71.02 111.085 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.422 ' CE3' HG12 ' A' ' 149' ' ' ILE . 39.5 m95 -102.5 160.51 14.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.94 -0.573 . . . . 70.35 110.102 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.434 ' CD1' ' N ' ' A' ' 135' ' ' TYR . 3.2 p90 -158.84 134.7 8.87 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.734 -0.386 . . . . 75.4 111.591 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.4 ' CG2' ' CG1' ' A' ' 5' ' ' VAL . 57.0 m -127.63 112.5 14.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.958 -0.564 . . . . 63.34 110.553 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.617 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.55 143.84 16.81 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.601 -0.809 . . . . 42.43 113.197 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.58 131.01 12.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.724 0.297 . . . . 75.54 110.384 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 83.2 mt -59.24 -178.74 0.06 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.399 -0.364 . . . . 52.23 110.951 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -55.24 -40.9 71.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 65.11 110.852 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.56 0.67 41.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.012 -0.54 . . . . 72.24 111.476 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.75 25.82 26.46 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.612 -0.804 . . . . 72.11 112.64 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.17 108.67 15.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.778 0.323 . . . . 73.42 110.873 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 27.5 t -65.89 124.46 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.449 . . . . 74.12 111.161 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.424 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 17.7 p90 -111.49 -28.41 8.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 71.32 111.013 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -161.19 115.33 2.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.31 -0.405 . . . . 75.45 111.007 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 55.1 m -125.36 116.41 21.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 55.12 110.891 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -86.12 14.65 6.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.921 -0.581 . . . . 55.54 111.636 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.422 HG12 ' CE3' ' A' ' 134' ' ' TRP . 14.8 mt . . . . . 0 C--N 1.331 -0.227 0 CA-C-O 120.767 0.318 . . . . 75.52 111.429 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.81 0.338 . . . . 75.43 111.036 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.3 mmtm -138.97 145.94 47.61 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.304 -0.407 . . . . 64.54 110.875 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.09 147.92 61.8 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.492 2.128 . . . . 74.43 112.339 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 3.9 tt -69.38 124.72 24.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 75.4 110.682 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.65 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.29 119.64 38.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.862 0.363 . . . . 53.42 111.081 179.803 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -149.39 140.82 23.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 75.32 110.855 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 75.8 mttt -78.69 139.51 38.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.009 0.433 . . . . 52.31 110.925 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 29.6 m -87.97 148.91 4.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.874 -0.603 . . . . 73.23 111.373 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.1 24.63 74.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.885 -0.674 . . . . 70.3 112.875 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 5.3 m -129.1 42.67 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.821 0.343 . . . . 72.44 111.101 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 41.8 35.45 1.51 Allowed Glycine 0 C--N 1.332 0.33 0 CA-C-N 116.046 -0.525 . . . . 72.23 113.319 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 6.1 mtpp -86.24 -43.65 12.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.814 0.34 . . . . 75.41 111.163 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 5.7 m -115.24 178.17 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.195 -0.457 . . . . 75.23 110.988 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.519 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.92 160.91 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.317 -0.401 . . . . 73.53 111.192 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 3.6 ttp-105 -67.81 -29.05 68.12 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.235 -0.438 . . . . 74.23 111.044 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.9 -37.19 44.9 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.659 -0.781 . . . . 65.14 112.081 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.519 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.0 t90 -78.73 -33.99 46.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.973 0.416 . . . . 75.21 110.983 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -63.87 -33.87 76.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.872 -0.604 . . . . 73.31 110.497 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -78.73 -29.42 45.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.016 -0.538 . . . . 72.31 110.706 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -80.0 -56.11 4.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 64.12 111.126 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.497 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 12.5 mt -61.65 -18.96 61.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.899 -0.592 . . . . 74.45 111.128 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.5 tp -58.38 -27.15 63.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.357 -0.383 . . . . 73.21 111.26 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 47.8 p -111.52 14.01 21.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.494 -0.321 . . . . 75.13 111.717 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.57 100.72 2.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.882 0.372 . . . . 74.44 110.691 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.53 159.46 24.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 75.35 111.255 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.52 116.11 4.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.859 -0.61 . . . . 75.45 111.038 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 79.17 11.84 84.64 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.936 -0.649 . . . . 71.25 113.075 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -87.39 146.31 25.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.963 0.411 . . . . 75.22 111.211 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -119.57 135.71 54.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.003 -0.544 . . . . 71.22 109.928 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -150.11 176.37 10.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.099 0.476 . . . . 63.33 111.9 -179.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.43 138.29 39.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.577 -0.738 . . . . 74.21 109.462 178.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.432 ' CD2' ' CE1' ' A' ' 216' ' ' PHE . 1.1 pt? -140.15 138.16 35.0 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.281 0.562 . . . . 75.22 112.41 -179.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -113.46 112.61 23.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.235 -0.893 . . . . 74.34 109.86 179.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.43 ' CD1' ' CZ ' ' A' ' 216' ' ' PHE . 1.9 mp -106.6 147.08 12.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.001 0.429 . . . . 74.32 111.596 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.407 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.1 OUTLIER -77.1 167.17 38.89 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.902 -0.59 . . . . 74.21 110.61 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 27.8 Cg_endo -62.4 -29.49 79.32 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.464 2.11 . . . . 73.22 112.384 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -66.15 -38.89 89.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.261 -0.427 . . . . 75.35 111.143 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . 0.424 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 18.8 m0 -96.88 36.9 1.35 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.357 -0.383 . . . . 74.41 111.027 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -158.66 -81.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 64.54 110.836 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -106.17 -71.39 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.972 0.415 . . . . 61.54 110.61 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 144.0 -176.0 23.55 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.756 -0.735 . . . . 50.24 112.743 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt -57.36 -35.26 69.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.866 0.365 . . . . 73.43 110.899 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -52.26 62.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 75.13 110.616 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.26 -143.68 15.73 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.878 -0.677 . . . . 74.12 112.559 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -151.97 91.15 3.75 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.606 0.241 . . . . 75.24 110.595 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -61.28 -24.21 78.43 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.548 2.165 . . . . 74.22 112.636 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.69 -42.14 74.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.887 0.375 . . . . 73.15 110.862 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -99.63 26.69 5.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.031 -0.531 . . . . 63.15 111.325 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.53 32.26 13.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.374 -0.376 . . . . 75.35 111.149 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . . . . . . . . . 19.1 mm -93.78 111.76 54.07 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 74.43 111.11 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.44 171.1 14.71 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.362 2.042 . . . . 71.33 112.217 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.33 120.75 7.92 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.492 2.128 . . . . 65.41 112.223 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 63.15 71.23 0.52 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 75.42 110.766 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.09 129.06 50.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 60.33 111.432 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.5 tttt -65.43 139.4 58.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.022 -0.535 . . . . 75.33 110.723 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.87 109.6 15.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.416 -0.356 . . . . 74.32 111.318 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 61.2 m -107.88 141.83 38.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 61.53 110.643 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.617 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 27.0 p90 -158.42 -178.83 7.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.066 0.46 . . . . 73.23 111.684 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -136.86 140.37 42.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.746 -0.661 . . . . 73.31 110.601 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.4 t -123.93 152.23 29.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.108 0.48 . . . . 74.23 111.913 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -136.64 109.78 7.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.635 -0.711 . . . . 74.32 110.289 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . 0.412 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.8 128.7 37.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.401 -0.363 . . . . 73.54 110.776 -179.681 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.42 -32.51 2.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.21 -0.45 . . . . 73.34 111.516 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -169.37 159.78 8.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.866 0.365 . . . . 70.14 111.077 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 3.4 mp -140.83 110.31 3.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.046 -0.524 . . . . 72.15 111.077 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.421 . . . . 54.33 110.916 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.4 t . . . . . 0 CA--C 1.528 0.12 0 CA-C-O 120.588 0.232 . . . . 54.25 110.642 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.453 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 87.1 Cg_endo -79.04 136.08 12.78 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.61 2.207 . . . . 75.23 112.582 -179.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -78.81 157.44 28.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 74.4 110.882 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.91 95.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 74.35 111.171 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.05 -18.0 63.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.489 . . . . 65.23 111.436 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.413 ' CD1' HD12 ' A' ' 20' ' ' LEU . 1.3 m-90 -137.2 173.74 11.36 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.94 0.4 . . . . 73.34 110.897 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.9 m -115.46 150.17 36.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.976 -0.556 . . . . 75.21 110.642 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.5 t -56.66 -31.79 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.917 0.389 . . . . 72.03 110.621 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -77.09 -25.56 52.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.968 -0.56 . . . . 73.31 111.042 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -82.21 -58.09 3.1 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.856 0.36 . . . . 75.33 110.833 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 mt -50.53 -61.08 2.4 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.196 -0.456 . . . . 73.13 111.004 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 22.3 mtt180 -54.16 -24.0 16.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.092 -0.504 . . . . 74.1 111.207 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.81 176.11 0.22 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.936 0.398 . . . . 73.52 111.115 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -110.3 16.65 21.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.022 -0.536 . . . . 73.24 111.161 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -106.9 -25.62 11.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.564 -0.289 . . . . 74.13 111.068 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.413 HD12 ' CD1' ' A' ' 10' ' ' TRP . 2.5 tt -88.05 112.69 50.95 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.413 -0.358 . . . . 74.35 110.957 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.37 125.46 18.99 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.433 2.088 . . . . 75.34 112.368 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.5 -24.12 66.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.162 -0.472 . . . . 75.22 111.156 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.0 -40.01 66.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.393 -0.367 . . . . 72.54 111.343 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.52 -56.79 5.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.219 -0.446 . . . . 75.53 111.063 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.9 mt -44.82 -31.37 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.88 -0.6 . . . . 75.42 111.446 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.7 mt -76.81 -38.8 30.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.931 0.396 . . . . 75.12 110.98 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -72.92 -24.67 60.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.988 -0.551 . . . . 75.31 111.075 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -71.46 -46.83 58.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.035 0.445 . . . . 74.32 110.812 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.4 mt -67.77 -25.03 65.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.838 -0.619 . . . . 72.33 110.994 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -78.55 -24.52 45.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.249 -0.432 . . . . 54.51 111.09 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.426 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 10.6 pt-20 -93.92 -41.29 9.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.808 0.337 . . . . 73.03 110.838 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.453 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 35.6 m170 -97.28 16.59 19.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 72.12 110.955 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.95 153.7 23.42 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.795 -0.717 . . . . 72.43 112.507 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.7 p -90.62 152.96 20.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.628 0.252 . . . . 72.32 110.507 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -49.32 -57.05 7.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.691 0.281 . . . . 71.21 111.116 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.8 t -47.95 -50.68 26.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.009 0.433 . . . . 65.14 110.685 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.458 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 9.0 t80 -53.56 -47.16 70.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.78 -0.646 . . . . 65.12 110.348 179.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.405 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 12.9 mt -66.29 -41.04 90.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.047 -0.524 . . . . 74.44 110.722 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.427 ' CB ' HD21 ' A' ' 44' ' ' LEU . . . -48.26 -45.56 34.66 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.028 0.442 . . . . 73.21 110.943 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -58.43 -27.29 64.2 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.722 -0.672 . . . . 73.44 110.78 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -112.74 11.88 19.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.207 -0.451 . . . . 75.44 111.124 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.9 mptt 51.22 33.61 9.9 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.85 0.357 . . . . 71.41 110.907 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 46.7 mt -91.35 -22.62 20.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.104 -0.498 . . . . 75.43 111.802 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.427 HD21 ' CB ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -77.37 157.98 30.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.018 0.437 . . . . 74.1 111.123 -179.73 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.73 -121.21 5.1 Favored Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 115.807 -0.633 . . . . 71.35 112.446 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -116.32 116.29 27.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.746 0.308 . . . . 74.31 110.914 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mp -45.74 -55.83 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.24 -0.437 . . . . 72.55 111.413 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -47.61 -37.88 13.45 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.86 -0.609 . . . . 71.52 111.022 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -85.7 -26.08 26.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.022 -0.536 . . . . 72.03 111.089 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 23.7 t -81.2 -25.8 10.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 75.44 111.418 -179.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.1 -15.63 63.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.381 -0.372 . . . . 70.22 111.15 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -95.14 -32.96 12.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.235 -0.439 . . . . 73.54 110.86 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -87.94 -29.67 20.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.22 -0.446 . . . . 73.24 111.042 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -96.2 125.55 40.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.301 -0.409 . . . . 71.52 111.1 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -81.2 175.14 10.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 74.31 110.588 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.98 -58.25 9.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.855 0.36 . . . . 75.55 110.552 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.9 -26.46 68.61 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.075 -0.512 . . . . 65.51 110.584 179.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.0 -44.23 97.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.094 0.473 . . . . 74.25 110.441 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 19.2 mt -71.23 -33.68 70.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.635 -0.711 . . . . 75.45 111.046 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 16.4 t -77.38 -42.2 30.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.295 -0.411 . . . . 75.42 110.802 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.4 m -59.61 -34.6 72.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.866 -0.606 . . . . 75.53 110.634 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.96 -21.5 37.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 65.51 111.074 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -82.84 -22.89 33.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 74.32 111.029 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -84.37 -53.74 5.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.331 -0.395 . . . . 75.34 111.507 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.458 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.6 p-80 -61.08 -33.09 72.8 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.125 -0.489 . . . . 73.22 111.257 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.434 HD22 ' CD2' ' A' ' 72' ' ' PHE . 5.3 tt -47.64 -40.24 19.22 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.962 0.41 . . . . 72.21 111.258 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.406 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.7 m-85 -77.8 -39.02 45.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.029 -0.532 . . . . 75.43 110.679 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -36.28 81.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.92 -0.582 . . . . 73.54 110.988 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.5 p -93.64 -6.65 45.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 71.34 111.475 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.18 36.45 15.81 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.71 0.29 . . . . 73.22 111.186 179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -93.97 44.07 1.12 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.363 -0.381 . . . . 73.13 110.979 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.434 ' CD2' HD22 ' A' ' 66' ' ' LEU . 87.8 m-85 -65.48 174.65 2.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 74.44 110.822 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.2 tttt . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.274 -0.421 . . . . 74.23 110.906 179.901 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.426 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.095 0 CA-C-O 120.734 0.302 . . . . 75.04 110.959 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 8.0 p90 -154.34 147.9 25.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.278 -0.419 . . . . 73.02 110.882 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 70.7 m -118.01 103.55 10.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 71.02 110.893 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.61 151.46 21.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.331 -0.395 . . . . 73.52 111.117 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.2 m -143.93 124.96 14.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.114 -0.494 . . . . 73.43 110.761 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 10.0 p -82.61 108.62 15.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.234 -0.439 . . . . 74.44 111.193 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -84.55 -47.86 10.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 75.32 110.784 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -117.63 107.9 14.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.177 -0.465 . . . . 75.32 110.949 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -62.15 134.35 56.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 75.31 110.917 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -104.52 -160.99 24.13 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.78 -0.724 . . . . 74.44 112.319 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -34.84 -47.33 0.34 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.917 0.389 . . . . 73.25 111.723 -179.411 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 72.44 37.59 0.9 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.945 -0.57 . . . . 74.24 110.484 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -162.08 -44.05 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.921 -0.581 . . . . 73.51 110.758 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -85.62 97.28 10.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 60.35 110.889 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -112.27 155.21 43.93 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.101 -0.499 . . . . 74.21 110.819 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -73.84 125.52 10.0 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.529 2.152 . . . . 75.23 112.57 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -96.07 160.16 14.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.005 -0.543 . . . . 75.33 110.913 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.74 116.12 2.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.234 -0.439 . . . . 75.13 110.981 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 101.08 -28.28 16.74 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.743 -0.742 . . . . 64.43 112.239 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -71.68 130.96 42.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.703 0.287 . . . . 75.04 110.4 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.519 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 12.4 m -73.59 176.17 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.072 0.463 . . . . 74.12 111.423 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.598 ' O ' ' HA ' ' A' ' 163' ' ' SER . 19.9 m -156.99 146.27 11.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.567 -0.742 . . . . 74.33 110.655 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.409 ' ND1' ' HB3' ' A' ' 163' ' ' SER . 0.5 OUTLIER -124.61 117.27 23.91 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.987 -0.285 . . . . 74.33 110.405 179.275 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . 0.434 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 29.7 p -155.38 169.96 23.01 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.075 0.464 . . . . 61.51 111.411 -179.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.426 ' CE3' HG13 ' A' ' 149' ' ' ILE . 60.7 m95 -102.26 160.45 14.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.735 -0.666 . . . . 72.11 110.234 179.369 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -158.25 134.64 9.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.977 0.418 . . . . 73.25 111.59 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 84.8 m -124.84 108.83 12.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.616 . . . . 74.3 110.174 179.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.6 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -93.76 143.7 16.67 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.594 -0.812 . . . . 73.32 113.38 -179.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -152.36 134.28 14.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.718 0.294 . . . . 72.21 110.574 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 52.9 mt -62.15 -179.73 0.24 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.425 -0.352 . . . . 72.42 110.672 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -54.74 -41.69 70.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.914 0.387 . . . . 73.22 110.836 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -80.68 0.35 34.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.016 -0.538 . . . . 72.2 111.488 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.19 25.85 27.66 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.644 -0.789 . . . . 60.35 112.542 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.8 m -80.77 108.34 14.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.828 0.347 . . . . 64.23 110.943 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 38.3 t -63.81 120.45 10.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 74.04 111.102 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.428 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 21.5 p90 -111.61 -24.43 10.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.222 -0.444 . . . . 70.25 111.104 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -162.18 112.63 1.56 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.799 0.333 . . . . 64.44 111.149 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 43.5 m -127.01 113.28 16.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 75.4 110.696 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -87.1 12.64 11.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 74.54 111.66 -179.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.449 ' CD1' ' N ' ' A' ' 149' ' ' ILE . 2.5 mp . . . . . 0 C--N 1.332 -0.184 0 CA-C-O 120.857 0.361 . . . . 75.21 111.003 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.79 0.329 . . . . 73.33 111.034 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.1 mttt -132.53 124.32 18.97 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 75.55 110.874 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.98 150.51 30.58 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.493 2.129 . . . . 71.43 112.294 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.417 HD22 ' CD1' ' A' ' 164' ' ' PHE . 0.5 OUTLIER -80.17 128.85 34.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.199 -0.455 . . . . 74.31 110.658 179.909 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.598 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 1.0 OUTLIER -109.45 127.3 54.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.322 -0.399 . . . . 65.55 111.313 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . 0.417 ' CD1' HD22 ' A' ' 162' ' ' LEU . 25.3 p90 -152.82 143.5 22.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.066 -0.516 . . . . 74.51 110.829 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . 0.519 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 2.2 mptt -71.02 132.34 45.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.337 -0.392 . . . . 74.23 110.9 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.7 m -87.68 149.26 4.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.142 -0.481 . . . . 64.51 111.06 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.74 24.46 75.47 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.792 -0.718 . . . . 44.4 112.64 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 14.4 m -134.03 46.42 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.845 0.355 . . . . 74.33 111.129 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.28 35.74 2.73 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 121.204 -0.522 . . . . 70.12 113.256 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt -81.19 -47.03 13.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.897 0.38 . . . . 75.13 110.952 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . 0.406 HG13 ' CE3' ' A' ' 175' ' ' TRP . 0.3 OUTLIER -118.64 -179.09 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.992 -0.549 . . . . 65.41 110.879 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.535 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.4 pt -57.8 158.85 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.418 -0.355 . . . . 71.43 111.074 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 25.5 ttm105 -67.45 -27.15 66.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.235 -0.439 . . . . 73.23 111.273 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.58 -36.65 37.43 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.679 -0.772 . . . . 74.12 112.188 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.535 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 1.9 t90 -77.86 -33.68 52.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.954 0.407 . . . . 72.0 111.014 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -62.27 -41.54 98.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.964 -0.562 . . . . 72.53 110.308 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.94 -29.78 65.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.9 -0.591 . . . . 71.43 110.547 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -78.7 -61.65 1.94 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 71.41 111.246 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.487 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 15.1 mt -58.9 -20.44 51.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.978 -0.556 . . . . 73.41 111.23 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 4.1 mt -60.37 -27.21 67.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.774 0.321 . . . . 75.43 110.883 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 69.9 p -107.78 10.27 28.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 73.41 111.598 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.35 99.41 2.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.87 0.367 . . . . 64.43 110.848 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.17 161.46 19.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 75.32 111.169 -179.557 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 10.8 tttt -59.88 114.99 3.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.827 -0.624 . . . . 74.52 111.227 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 81.3 8.62 86.97 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.961 -0.638 . . . . 72.33 113.126 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -85.4 139.7 31.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.028 0.442 . . . . 74.4 111.404 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -117.08 139.28 50.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.861 -0.609 . . . . 74.23 109.927 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -148.01 175.39 11.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 73.02 112.061 -179.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.63 121.39 17.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.41 -0.813 . . . . 72.13 109.56 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -134.36 143.42 47.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.346 0.593 . . . . 65.41 112.351 -178.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . 0.4 ' HG2' ' CG2' ' A' ' 215' ' ' THR . 4.2 mt-10 -114.87 117.42 30.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.135 -0.939 . . . . 71.44 109.945 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.449 ' CD1' ' CZ ' ' A' ' 216' ' ' PHE . 2.2 mt -108.28 137.15 41.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.972 0.415 . . . . 71.02 111.495 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.63 164.94 45.89 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 70.35 110.57 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . 0.433 ' HG3' ' HA ' ' A' ' 211' ' ' ASN . 19.4 Cg_endo -59.03 -35.24 98.79 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.568 2.179 . . . . 75.25 112.226 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -56.54 -43.53 79.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 50.41 111.411 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . 0.426 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 12.5 m0 -96.64 34.96 1.57 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.884 0.373 . . . . 72.32 111.169 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -159.38 -78.78 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.004 -0.544 . . . . 72.1 110.727 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.442 ' CE2' ' CD1' ' A' ' 208' ' ' ILE . 47.1 m-85 -105.47 -71.28 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.0 0.429 . . . . 73.23 110.401 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.23 178.4 16.43 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.763 -0.732 . . . . 71.22 112.953 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -56.98 -31.7 65.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.811 0.339 . . . . 71.3 110.803 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -53.3 58.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.464 . . . . 75.23 110.609 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 107.61 -147.3 16.35 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.845 -0.693 . . . . 63.11 112.518 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . 0.418 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.0 OUTLIER -156.61 82.9 3.29 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.779 0.323 . . . . 73.51 110.656 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -51.13 -35.7 52.66 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.749 2.3 . . . . 73.44 112.638 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.7 -42.1 83.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.855 0.359 . . . . 74.45 111.009 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -101.77 27.17 6.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.052 -0.522 . . . . 74.35 111.361 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 51.7 31.04 7.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.366 -0.379 . . . . 74.3 111.09 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . 0.442 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 24.5 mt -89.17 111.71 46.77 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 72.11 111.181 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -74.5 164.85 33.0 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.451 2.101 . . . . 71.32 112.397 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.99 147.89 50.36 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.651 2.234 . . . . 74.33 112.347 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . 0.433 ' HA ' ' HG3' ' A' ' 194' ' ' PRO . 70.7 m-80 51.13 36.22 15.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 73.12 111.03 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -82.58 142.14 32.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 74.12 111.978 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -97.24 159.2 15.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.677 -0.692 . . . . 73.14 109.873 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.41 HD13 ' CE2' ' A' ' 198' ' ' TYR . 3.0 mt -134.39 108.99 8.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.988 0.423 . . . . 74.43 111.951 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 215' ' ' THR . . . . . 0.4 ' CG2' ' HG2' ' A' ' 191' ' ' GLU . 25.5 m -103.06 139.68 38.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.873 -0.603 . . . . 75.02 110.449 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.6 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 12.4 p90 -158.75 179.27 9.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.097 0.475 . . . . 70.11 111.894 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -136.67 140.32 42.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.543 -0.753 . . . . 74.42 110.593 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 4.4 t -124.12 151.8 29.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.087 0.47 . . . . 72.33 111.986 -178.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -135.97 109.21 7.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.608 -0.724 . . . . 74.21 110.106 179.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . 0.434 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.71 127.89 34.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.313 -0.403 . . . . 71.04 110.936 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 22.0 t -109.06 -29.46 2.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.167 -0.469 . . . . 63.4 111.33 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -169.59 160.34 8.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.412 -0.358 . . . . 65.41 110.916 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 3.4 mp -139.24 110.17 4.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 74.25 111.106 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 75.54 110.892 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 24.0 t . . . . . 0 CA--C 1.528 0.106 0 CA-C-O 120.58 0.229 . . . . 73.44 111.165 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.449 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.5 Cg_endo -78.4 137.61 15.02 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.608 2.206 . . . . 71.33 112.419 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.402 ' O ' ' N ' ' A' ' 9' ' ' ALA . 7.6 mm-40 -80.2 154.72 27.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.246 -0.433 . . . . 71.41 110.852 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.34 89.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.107 -0.497 . . . . 72.45 111.373 -179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.402 ' N ' ' O ' ' A' ' 7' ' ' GLN . . . -60.69 -34.55 74.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 73.04 111.056 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.417 ' CD1' HD12 ' A' ' 20' ' ' LEU . 1.5 m-90 -116.09 173.74 6.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.489 . . . . 72.53 110.965 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.3 m -116.25 152.18 34.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.944 -0.571 . . . . 65.51 110.535 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t -56.6 -33.64 40.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.912 0.386 . . . . 72.02 110.854 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -74.13 -25.7 59.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.989 -0.55 . . . . 74.21 111.181 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -82.12 -56.91 3.65 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.806 0.336 . . . . 73.44 110.994 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mt -49.6 -63.73 1.02 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.258 -0.428 . . . . 73.45 111.116 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 22.5 mtt180 -53.92 -24.72 17.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.484 . . . . 74.51 111.187 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.17 178.23 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.034 0.445 . . . . 74.43 111.256 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -110.41 17.05 21.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.827 -0.624 . . . . 74.22 111.179 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.67 -24.89 11.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.588 -0.278 . . . . 73.44 111.231 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.417 HD12 ' CD1' ' A' ' 10' ' ' TRP . 6.2 tt -89.07 116.27 65.88 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.414 -0.357 . . . . 74.44 111.054 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.29 124.41 15.81 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.437 2.091 . . . . 73.32 112.235 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -24.18 65.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 74.24 111.206 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -57.75 -32.97 67.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.388 -0.369 . . . . 74.42 111.335 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -78.87 -53.07 7.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.923 0.392 . . . . 73.22 111.133 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 34.9 mt -46.54 -35.66 2.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.899 -0.592 . . . . 71.42 111.411 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 6.2 mt -75.74 -44.72 39.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 74.52 111.012 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.78 -25.18 64.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.01 -0.541 . . . . 74.33 110.925 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 38.3 t80 -70.05 -44.01 70.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 74.21 110.65 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.5 mt -71.32 -24.21 62.08 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.752 -0.658 . . . . 75.2 110.92 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -76.34 -25.15 54.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.282 -0.417 . . . . 74.21 110.803 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -102.35 -10.51 19.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.236 -0.438 . . . . 73.41 111.095 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 13.1 m170 -117.09 -11.43 10.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.425 -0.352 . . . . 72.22 111.371 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -120.3 164.69 13.8 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.679 -0.772 . . . . 62.21 112.391 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.77 149.58 21.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.599 0.238 . . . . 73.12 110.468 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -48.51 -57.15 6.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.79 0.328 . . . . 62.35 111.016 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.3 p -47.89 -51.67 22.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.909 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.516 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 4.7 t80 -53.48 -46.85 70.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.835 -0.621 . . . . 72.12 110.387 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 13.2 mt -65.34 -41.47 93.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.0 -0.545 . . . . 71.04 110.744 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.11 -43.64 31.21 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.961 0.41 . . . . 74.14 111.034 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -58.87 -27.96 65.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.905 -0.589 . . . . 63.53 110.834 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 39.1 m-70 -112.75 10.28 19.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.155 -0.475 . . . . 71.32 111.169 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.4 mttp 55.24 36.98 28.2 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.89 0.376 . . . . 63.01 110.823 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.7 mt -94.97 -21.84 18.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.109 -0.496 . . . . 72.33 111.898 -179.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.24 155.51 32.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.12 0.486 . . . . 75.23 111.201 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.27 -123.51 5.89 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.626 -0.715 . . . . 75.34 112.427 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -116.38 118.04 31.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.75 0.309 . . . . 73.4 110.986 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.1 mp -45.16 -52.22 2.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.167 -0.47 . . . . 70.3 111.401 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -47.34 -37.16 10.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.907 -0.588 . . . . 73.43 110.974 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -85.65 -25.67 26.45 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.921 -0.581 . . . . 73.24 111.205 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.5 t -83.45 -25.94 7.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.384 -0.371 . . . . 73.52 111.453 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.78 -17.93 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.441 -0.345 . . . . 72.04 111.406 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.6 pttp -95.09 -33.8 12.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.829 0.347 . . . . 75.13 110.995 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.5 m -87.38 -31.0 20.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.228 -0.442 . . . . 75.33 111.031 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.68 127.7 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 71.13 111.17 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -83.41 176.77 8.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 73.42 110.683 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.54 -58.25 9.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.869 0.366 . . . . 73.34 110.515 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.39 -29.49 70.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.141 -0.481 . . . . 74.54 110.308 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -42.22 98.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 74.41 110.435 179.645 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.8 mt -72.03 -35.75 69.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.734 -0.666 . . . . 74.52 110.87 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 17.3 t -75.57 -41.24 41.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.213 -0.449 . . . . 74.51 110.826 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.6 m -60.45 -34.0 73.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.895 -0.593 . . . . 52.44 110.428 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.409 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -80.7 -21.24 41.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 72.53 110.932 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -83.86 -22.95 31.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.077 -0.51 . . . . 74.44 111.017 179.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -84.89 -54.51 4.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.23 -0.441 . . . . 73.34 111.512 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.516 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.4 p-80 -61.31 -26.28 67.68 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.076 -0.511 . . . . 75.03 111.056 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.435 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.7 tt -53.08 -39.81 63.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.938 0.399 . . . . 74.2 110.976 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -78.23 -37.66 44.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.981 -0.554 . . . . 74.2 110.599 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.62 -36.51 78.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.974 -0.557 . . . . 72.52 110.818 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 46.6 p -88.9 -9.82 50.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.033 -0.531 . . . . 75.21 111.454 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 50.5 37.69 16.53 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.754 0.312 . . . . 70.1 111.234 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 37.1 mtt180 -100.3 47.54 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.286 -0.416 . . . . 75.35 110.975 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.426 ' CD2' ' HD2' ' A' ' 6' ' ' PRO . 75.1 m-85 -69.22 178.61 2.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.164 -0.471 . . . . 74.23 110.924 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 74.12 110.749 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.414 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.853 0.359 . . . . 74.44 110.936 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.409 ' CE2' ' HB3' ' A' ' 178' ' ' ALA . 41.4 p90 -151.59 155.08 37.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.273 -0.421 . . . . 71.35 110.931 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 71.5 m -122.88 103.5 8.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.161 -0.472 . . . . 71.21 110.845 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . 0.405 ' HG3' ' HB3' ' A' ' 190' ' ' LEU . 0.0 OUTLIER -89.48 151.38 22.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.275 -0.421 . . . . 64.21 111.125 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -144.89 112.83 6.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 75.43 110.837 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 19.5 t -81.94 106.36 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 74.1 111.29 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -83.21 -41.81 17.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 72.22 110.844 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 4.6 tptt -128.44 108.13 10.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 73.12 110.984 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -59.44 144.67 46.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 72.02 110.966 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.507 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -115.66 -156.55 11.03 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.721 -0.752 . . . . 64.32 112.642 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -35.84 -52.32 0.72 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.022 0.439 . . . . 74.53 111.576 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.9 tttp 69.9 33.47 2.82 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.834 -0.621 . . . . 74.15 110.325 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -152.33 -44.57 0.1 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.796 -0.638 . . . . 73.3 110.651 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -91.01 98.41 11.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 74.31 110.841 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -108.08 157.16 36.91 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 71.42 110.913 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.93 125.83 11.34 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.577 2.185 . . . . 74.25 112.407 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -96.88 155.08 16.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 74.44 110.889 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -62.69 117.12 5.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 75.14 110.861 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 104.78 -22.96 32.43 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.612 -0.804 . . . . 74.34 112.647 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -85.95 140.17 30.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.756 0.312 . . . . 75.31 110.818 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.532 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 22.2 m -69.09 173.24 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.971 0.415 . . . . 71.43 111.328 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.666 ' O ' ' HA ' ' A' ' 163' ' ' SER . 15.9 m -156.89 145.77 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.717 -0.674 . . . . 62.53 110.588 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.461 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.95 117.89 22.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.659 0.266 . . . . 75.01 110.665 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 25.1 p -150.28 173.92 13.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.118 0.485 . . . . 73.03 111.407 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.461 ' HB3' ' CD1' ' A' ' 149' ' ' ILE . 87.5 m95 -108.25 157.58 18.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.552 -0.749 . . . . 75.23 110.057 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.452 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 40.3 p90 -162.23 138.37 7.67 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.223 0.535 . . . . 73.23 112.145 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 12.3 m -129.69 114.57 16.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.426 -0.806 . . . . 71.04 110.151 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.589 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.06 146.01 18.11 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.544 -0.836 . . . . 70.42 113.328 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.22 147.8 27.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.816 0.341 . . . . 75.5 110.766 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 12.6 mt -81.72 -177.18 6.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 74.43 110.851 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -59.66 -43.1 94.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.45 . . . . 74.52 110.885 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.04 -5.73 56.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.981 -0.554 . . . . 72.44 111.357 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 98.44 25.42 10.11 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.7 -0.762 . . . . 42.44 112.648 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.08 109.65 20.69 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.827 0.346 . . . . 71.01 110.761 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . 0.406 ' HA ' ' O ' ' A' ' 137' ' ' GLY . 3.0 m -63.69 135.1 28.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.446 . . . . 72.53 111.296 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.437 ' CD1' ' N ' ' A' ' 146' ' ' ASP . 21.0 p90 -116.85 -40.99 3.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.094 -0.503 . . . . 64.25 110.643 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . 0.437 ' N ' ' CD1' ' A' ' 145' ' ' PHE . 70.6 m-20 -143.65 110.3 5.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.914 -0.584 . . . . 71.11 110.374 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 25.0 m -134.1 107.72 7.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.941 0.401 . . . . 75.23 111.455 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . 0.452 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 27.8 t30 -90.32 44.3 1.19 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.958 -0.565 . . . . 70.14 110.21 179.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.461 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 35.5 mm . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 62.01 110.893 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.798 0.333 . . . . 74.03 111.075 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 13.5 mmtt -140.8 145.97 42.12 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 74.34 110.897 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -69.71 152.93 69.68 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.549 2.166 . . . . 60.44 112.31 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 2.0 tt -73.67 123.09 23.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 74.54 110.48 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.666 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.39 120.83 40.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.939 0.4 . . . . 75.43 111.266 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 13.9 p90 -149.67 141.13 23.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.029 -0.532 . . . . 74.44 110.786 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . 0.532 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 28.2 mtmt -77.34 138.17 39.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.958 0.409 . . . . 72.1 110.895 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 29.8 m -87.5 148.92 4.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.945 -0.57 . . . . 73.42 111.051 -179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 66.01 25.59 72.11 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.688 -0.768 . . . . 73.23 112.098 -179.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 1.9 t -130.98 40.98 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.843 0.354 . . . . 74.31 111.016 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.54 35.18 5.38 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 121.05 -0.595 . . . . 72.41 112.966 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.31 -47.05 11.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.906 0.384 . . . . 73.05 111.064 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.3 m -117.48 179.73 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.095 -0.502 . . . . 73.21 111.058 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.493 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -59.95 160.11 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.332 -0.394 . . . . 71.14 111.12 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -68.04 -28.89 67.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.264 -0.426 . . . . 74.45 111.193 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.83 -37.82 43.6 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.64 -0.79 . . . . 74.14 111.943 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.493 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.3 t90 -79.03 -34.06 44.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.043 0.449 . . . . 73.11 110.964 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -65.16 -31.16 72.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.756 -0.656 . . . . 74.12 110.602 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -82.0 -28.53 32.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 75.14 110.833 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . 0.409 ' HB3' ' CE2' ' A' ' 111' ' ' TYR . . . -80.32 -62.01 1.81 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.226 -0.443 . . . . 71.04 111.168 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.477 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 6.4 mt -50.29 -32.56 17.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.972 -0.558 . . . . 75.32 110.824 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.54 -24.58 21.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.138 -0.483 . . . . 74.41 110.957 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 24.9 p -97.54 1.84 49.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.253 -0.431 . . . . 65.44 111.707 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.68 152.77 29.75 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.765 0.316 . . . . 64.41 110.565 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 10.3 p -120.94 173.07 7.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.977 0.418 . . . . 74.5 111.505 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.61 117.4 7.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.808 -0.633 . . . . 74.05 110.574 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.43 66.46 2.24 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.614 -0.803 . . . . 53.54 112.085 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . 0.507 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 30.9 tt0 -145.05 144.4 30.96 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.623 0.249 . . . . 74.54 110.461 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -119.26 137.24 53.8 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.204 -0.295 . . . . 72.53 110.204 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -144.26 173.1 12.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.149 0.499 . . . . 75.03 111.865 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.57 101.14 4.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.527 -0.761 . . . . 65.54 109.752 179.413 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.428 ' HG ' ' CE1' ' A' ' 216' ' ' PHE . 1.0 OUTLIER -115.61 142.26 46.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.123 0.487 . . . . 74.45 111.947 -178.827 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -114.14 119.28 36.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.651 -0.704 . . . . 74.25 110.207 179.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.414 HG12 ' CE2' ' A' ' 216' ' ' PHE . 1.8 mm -99.51 143.93 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.858 0.361 . . . . 72.15 111.262 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.42 165.4 46.54 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.075 -0.512 . . . . 71.44 110.602 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -64.51 -43.57 13.32 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.486 2.124 . . . . 72.44 112.264 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -54.67 -24.28 21.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 73.54 111.304 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . 0.414 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 8.5 m0 -115.93 36.94 3.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.404 -0.362 . . . . 75.4 111.122 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -156.67 -81.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.259 -0.428 . . . . 61.42 111.363 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.453 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 17.2 m-85 -104.76 -31.19 9.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.899 0.381 . . . . 70.23 110.937 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 107.25 168.42 22.09 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.747 -0.74 . . . . 73.22 112.575 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -30.62 67.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.846 0.355 . . . . 72.33 110.896 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 6.8 pttt -59.91 -48.12 83.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.245 -0.434 . . . . 74.02 110.754 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.68 161.78 24.08 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.801 -0.714 . . . . 74.32 112.467 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . 0.428 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.3 OUTLIER -105.77 89.1 3.27 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 120.65 0.262 . . . . 75.11 110.809 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.37 -22.25 52.83 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.502 2.134 . . . . 64.51 112.369 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.3 -40.51 82.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.304 -0.407 . . . . 73.14 110.923 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -109.26 27.13 9.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 73.44 111.254 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 11.0 tttt 56.84 54.4 7.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.249 -0.432 . . . . 74.31 111.044 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . 0.434 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 42.4 mt -118.36 111.68 38.13 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 74.42 111.125 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.37 172.54 1.86 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.516 2.144 . . . . 75.23 112.309 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.2 127.53 12.09 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.583 2.188 . . . . 74.11 112.332 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 30.3 m-20 63.9 71.23 0.49 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.277 -0.419 . . . . 74.53 110.852 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.84 128.59 49.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 54.43 111.248 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -65.59 141.37 58.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.477 . . . . 74.12 110.735 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.453 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 22.8 mt -121.79 109.61 14.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 74.4 111.117 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.95 136.83 46.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.36 -0.382 . . . . 72.33 110.778 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.589 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 18.0 p90 -152.92 176.94 11.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.992 0.425 . . . . 74.5 111.268 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -130.92 135.0 47.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.843 -0.617 . . . . 75.22 110.31 179.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 2.6 t -120.24 150.13 22.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.076 0.465 . . . . 64.21 112.122 -178.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -136.75 107.63 6.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.617 -0.72 . . . . 75.41 110.192 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 3.0 tt -70.37 134.47 47.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.38 -0.373 . . . . 73.53 111.046 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 20.9 t -111.3 -29.81 2.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.207 -0.451 . . . . 75.03 111.446 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -173.0 163.87 4.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.855 0.359 . . . . 74.51 111.112 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 2.7 mp -139.86 110.42 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 74.13 110.984 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 74.13 110.836 179.87 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.411 ' CG1' ' CG2' ' A' ' 136' ' ' THR . 34.9 t . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.636 0.255 . . . . 74.13 111.112 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.448 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.7 Cg_endo -78.42 142.54 18.75 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.615 2.21 . . . . 72.43 112.512 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -83.84 153.48 24.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 71.42 110.833 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.17 110.45 0.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.184 -0.462 . . . . 74.32 111.327 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.56 -18.98 43.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.495 . . . . 64.21 111.2 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.449 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 1.4 m-90 -135.01 172.92 12.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.067 0.461 . . . . 64.34 110.761 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.4 m -110.2 148.58 31.56 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.731 -0.668 . . . . 73.12 110.103 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.48 ' O ' ' CG ' ' A' ' 16' ' ' ARG . 58.2 t -56.32 -33.58 38.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.96 0.41 . . . . 74.45 110.211 179.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' SER . 3.9 mt-10 -69.92 -25.74 63.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.803 -0.635 . . . . 72.03 110.791 179.222 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -82.02 -54.9 4.93 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.337 -0.392 . . . . 72.13 111.273 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mt -50.0 -66.71 0.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.082 0.401 . . . . 73.44 112.082 -178.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.48 ' CG ' ' O ' ' A' ' 12' ' ' VAL . 1.8 ptm180 -61.59 -23.09 65.77 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 120.895 -0.322 . . . . 73.1 111.622 -178.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 0.5 OUTLIER -54.61 178.57 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.739 0.304 . . . . 70.41 110.847 179.773 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -110.27 11.39 23.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.326 -0.397 . . . . 73.44 111.434 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -103.47 -26.18 12.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.765 0.317 . . . . 73.43 111.12 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.449 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 8.5 tt -87.53 130.72 46.24 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.348 -0.387 . . . . 74.11 110.91 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -74.25 127.92 11.65 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.505 2.137 . . . . 54.14 112.369 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -25.06 66.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 75.04 111.193 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.8 mmtp -54.08 -39.19 66.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.852 0.358 . . . . 72.34 111.351 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.41 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 0.8 OUTLIER -70.05 -58.35 3.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.198 -0.456 . . . . 74.51 111.093 -179.896 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 17.9 mt -44.7 -32.62 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.864 -0.607 . . . . 64.13 111.577 -179.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 8.1 mt -75.11 -37.2 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.363 -0.381 . . . . 74.14 111.008 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 mttm -72.43 -23.88 61.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.016 -0.538 . . . . 73.43 111.258 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -73.73 -45.88 49.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.967 0.413 . . . . 73.14 110.917 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.6 mt -67.89 -24.96 65.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.862 -0.608 . . . . 74.42 110.998 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -80.46 -27.86 37.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.35 -0.386 . . . . 74.01 110.98 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.417 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 15.7 pt-20 -94.01 -41.63 9.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.298 -0.41 . . . . 63.1 111.034 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.448 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 21.2 m170 -98.51 16.54 21.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.285 -0.416 . . . . 65.12 111.035 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.26 154.37 23.98 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.81 -0.71 . . . . 75.2 112.525 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.1 p -88.6 148.26 24.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.66 0.267 . . . . 72.45 110.653 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -48.8 -57.12 6.87 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.784 0.325 . . . . 73.02 110.988 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.5 t -48.03 -51.15 25.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.195 -0.457 . . . . 71.53 110.724 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.498 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 17.1 t80 -55.12 -45.55 75.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.759 -0.655 . . . . 75.24 110.16 179.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.4 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 14.7 mt -63.47 -43.56 96.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.933 -0.576 . . . . 74.12 110.477 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -47.5 -34.26 7.29 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.13 -0.487 . . . . 71.11 110.575 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -50.55 -48.36 57.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.65 -0.704 . . . . 73.43 110.76 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -106.36 16.25 25.01 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.947 -0.57 . . . . 74.44 110.883 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.8 mttt 57.27 40.95 27.45 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.833 0.349 . . . . 75.15 110.952 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 51.0 mt -91.59 -25.38 19.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 62.14 111.597 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.4 ' N ' ' HB3' ' A' ' 38' ' ' LEU . 0.3 OUTLIER -69.79 158.34 35.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.017 0.437 . . . . 71.55 111.114 -179.761 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.19 -124.77 6.45 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.775 -0.648 . . . . 75.2 112.359 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -116.39 122.57 45.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.794 0.33 . . . . 71.2 110.88 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mp -46.13 -49.4 5.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.219 -0.446 . . . . 74.22 111.29 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.5 mttt -50.75 -39.56 52.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.98 -0.555 . . . . 71.45 110.846 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -85.68 -26.28 26.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.869 -0.605 . . . . 73.3 110.934 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 28.5 t -78.8 -25.85 13.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 75.12 111.284 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.56 -19.98 64.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.398 -0.364 . . . . 71.2 111.252 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.1 ptpt -95.06 -33.05 12.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.379 -0.373 . . . . 73.44 110.909 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.83 31.79 2.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 73.52 110.977 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -156.08 125.07 6.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 74.12 111.061 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -84.07 171.7 12.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 72.34 110.722 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.71 -58.08 9.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.917 0.389 . . . . 74.54 110.556 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.3 -25.71 67.3 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.036 -0.529 . . . . 44.43 110.537 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -46.83 84.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 70.12 110.515 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 21.9 mt -72.15 -31.18 65.74 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.657 -0.702 . . . . 73.12 111.228 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 15.2 t -79.75 -42.82 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.974 0.416 . . . . 63.41 110.907 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 92.2 m -59.33 -38.02 79.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.941 -0.572 . . . . 73.25 110.774 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -80.89 -21.81 40.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.314 -0.403 . . . . 74.12 111.108 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.407 ' CD1' ' O ' ' A' ' 63' ' ' TYR . 12.9 t80 -82.85 -22.87 33.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 73.41 110.986 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 31.8 m-20 -84.97 -53.62 5.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 51.23 111.583 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.498 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.2 p-80 -61.6 -30.3 70.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.134 -0.485 . . . . 75.23 111.364 -179.423 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.444 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.1 tt -50.21 -39.83 45.43 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.875 0.369 . . . . 74.21 111.101 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -78.8 -36.79 42.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.065 -0.516 . . . . 75.12 110.598 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.12 -38.16 81.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 73.23 110.843 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.8 p -92.73 -6.25 49.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.024 -0.535 . . . . 73.35 111.387 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt 51.55 36.53 17.28 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.768 0.318 . . . . 75.34 111.34 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 41.9 mtt-85 -93.48 44.18 1.13 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.34 -0.391 . . . . 73.21 111.026 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.427 ' CD2' HD23 ' A' ' 66' ' ' LEU . 85.3 m-85 -64.59 173.12 2.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.297 -0.41 . . . . 73.44 110.786 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 53.1 tttp . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.273 -0.422 . . . . 74.4 110.9 -179.996 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.47 ' CG ' ' CD1' ' A' ' 196' ' ' TRP . 8.4 mmtt . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.658 0.266 . . . . 71.51 111.043 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -132.62 151.16 52.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.904 0.383 . . . . 71.32 111.022 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 63.8 m -130.94 103.64 6.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.034 -0.53 . . . . 73.32 111.099 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -101.73 142.31 33.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.331 -0.395 . . . . 74.13 110.978 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.5 m -140.78 118.0 11.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.477 . . . . 70.44 110.76 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 39.7 t -57.65 154.75 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 75.22 111.336 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 4.1 mp -132.8 -46.59 0.87 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.977 -0.556 . . . . 73.0 110.571 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.7 tttm -130.42 108.23 9.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.006 -0.543 . . . . 74.55 110.707 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 20.0 pttt -61.2 131.54 50.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 70.11 110.913 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -100.12 -106.06 2.76 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.713 -0.756 . . . . 74.41 112.345 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.44 -40.21 11.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.916 0.389 . . . . 75.43 110.733 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.9 mtmt 66.75 32.56 6.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.969 -0.56 . . . . 70.12 110.686 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 63.3 m -148.61 -45.14 0.15 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.06 -0.518 . . . . 74.25 110.947 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -91.24 122.24 33.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 54.51 111.0 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -129.07 147.55 65.33 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 75.11 110.88 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.96 127.4 24.76 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.592 2.195 . . . . 61.42 112.472 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.2 140.66 32.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.182 -0.463 . . . . 75.55 110.777 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -51.88 113.71 1.08 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.242 -0.436 . . . . 74.44 111.172 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.89 -15.14 55.75 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.729 -0.748 . . . . 75.23 112.741 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -88.1 140.95 28.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.826 0.346 . . . . 74.31 111.028 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.438 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 7.6 p -70.91 163.29 3.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.08 -0.509 . . . . 74.31 110.974 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.632 ' O ' ' HA ' ' A' ' 163' ' ' SER . 14.0 m -155.21 146.76 13.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 74.2 111.176 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.469 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.64 118.0 23.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.711 0.291 . . . . 65.12 110.751 179.705 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 28.1 p -149.04 166.59 28.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.035 0.445 . . . . 74.41 111.207 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.455 ' HB3' ' CD1' ' A' ' 149' ' ' ILE . 93.3 m95 -101.8 160.16 14.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.766 -0.652 . . . . 73.15 110.261 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.449 ' CE2' ' ND2' ' A' ' 148' ' ' ASN . 53.1 p90 -163.28 139.48 6.99 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.129 0.49 . . . . 75.21 112.1 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.411 ' CG2' ' CG1' ' A' ' 5' ' ' VAL . 6.9 m -131.22 116.04 17.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.575 -0.739 . . . . 74.42 110.108 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.54 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.65 144.61 17.34 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.661 -0.78 . . . . 55.35 113.443 -179.26 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.75 136.32 16.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.808 0.337 . . . . 74.43 110.411 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 31.3 mt -67.81 -178.34 0.94 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 73.01 110.979 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -56.59 -42.1 78.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 75.15 110.89 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.43 -2.48 35.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.976 -0.557 . . . . 74.13 111.504 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 88.57 25.78 29.38 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.664 -0.779 . . . . 50.52 112.672 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 31.0 m -90.61 116.37 28.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.8 0.333 . . . . 72.44 110.816 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 24.1 t -63.61 130.24 28.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 74.45 111.064 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.427 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 55.1 p90 -114.68 -31.06 6.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 74.24 111.106 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . 0.417 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 2.7 m-20 -168.1 117.5 0.77 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.385 -0.371 . . . . 71.41 111.072 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 15.0 t -142.87 129.52 20.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 75.01 110.94 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . 0.449 ' ND2' ' CE2' ' A' ' 135' ' ' TYR . 35.8 p-10 -92.54 50.08 1.56 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.262 -0.426 . . . . 65.43 110.373 179.544 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.455 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 19.2 mm . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.126 -0.488 . . . . 74.3 110.893 -179.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 120.837 0.351 . . . . 55.05 111.032 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -137.13 133.76 18.61 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 65.02 110.897 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . 0.428 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 34.5 Cg_exo -56.95 155.94 25.97 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.37 2.047 . . . . 63.25 112.204 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 2.6 tt -77.96 119.67 21.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.452 . . . . 75.54 110.382 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.632 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -97.69 121.84 40.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.395 . . . . 75.14 111.384 -179.721 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 10.8 p90 -150.36 142.67 24.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.995 -0.548 . . . . 73.43 110.597 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 7.2 mtpt -81.26 141.03 34.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.981 0.42 . . . . 65.04 111.028 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.0 m -87.44 149.18 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.837 -0.62 . . . . 72.04 111.138 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 66.91 26.28 73.2 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.792 -0.718 . . . . 71.3 112.269 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 2.0 t -131.18 41.19 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.831 0.348 . . . . 75.43 110.984 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.02 34.84 3.23 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 121.105 -0.569 . . . . 73.3 112.966 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.62 -45.8 13.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.885 0.374 . . . . 73.04 111.016 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.1 m -118.41 179.55 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.042 -0.526 . . . . 73.24 111.066 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.504 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -61.82 159.07 2.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.262 -0.426 . . . . 74.43 111.246 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -65.08 -30.16 71.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.158 -0.474 . . . . 73.23 111.292 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.8 -36.21 43.04 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.529 -0.843 . . . . 53.43 112.197 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.504 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.5 t90 -80.22 -36.06 35.3 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.914 0.388 . . . . 72.03 110.91 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -60.89 -36.4 79.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.993 -0.549 . . . . 75.4 110.37 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -78.04 -29.04 49.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.957 -0.565 . . . . 71.02 110.627 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -77.71 -60.44 2.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.202 -0.453 . . . . 75.04 111.144 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.49 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 7.1 mt -55.54 -35.98 66.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.984 -0.553 . . . . 74.02 110.897 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.7 tp -62.11 -28.77 69.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.224 -0.444 . . . . 70.12 110.835 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 37.0 p -89.32 -8.54 53.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 75.14 111.369 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 9.4 mmm -75.47 159.4 31.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.762 0.315 . . . . 75.24 110.829 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.91 166.78 10.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 73.23 111.079 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 5.5 tttm -65.56 123.35 19.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 73.44 111.095 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 70.24 39.27 71.79 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.737 -0.744 . . . . 55.25 112.702 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -121.16 149.78 42.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.834 0.35 . . . . 75.02 110.999 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -116.53 139.29 50.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 75.03 110.226 179.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -147.79 175.84 10.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.058 0.456 . . . . 73.31 111.642 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.7 124.49 21.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.722 -0.672 . . . . 73.31 109.838 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -135.91 142.14 44.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.187 0.518 . . . . 74.41 112.152 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -117.35 113.42 22.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.416 -0.811 . . . . 74.24 110.15 179.302 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.481 ' CD1' ' CZ ' ' A' ' 216' ' ' PHE . 4.6 mp -96.57 142.77 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.975 0.417 . . . . 73.43 111.458 -179.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -78.77 164.43 55.51 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 115.88 -0.6 . . . . 74.21 110.834 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.83 -41.43 75.53 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.661 2.241 . . . . 62.34 112.409 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -63.28 -39.0 93.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 71.03 111.162 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . 0.47 ' CD1' ' CG ' ' A' ' 110' ' ' LYS . 9.0 m0 -96.3 27.1 3.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.359 -0.382 . . . . 74.33 111.103 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -150.04 -81.84 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 73.22 110.792 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -104.25 -71.27 0.74 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.039 0.447 . . . . 74.23 110.444 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 145.83 -174.36 25.82 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.823 -0.703 . . . . 72.02 112.808 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -56.9 -40.96 77.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.826 0.346 . . . . 73.55 110.895 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.46 -52.01 65.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.126 -0.488 . . . . 74.54 110.592 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.1 -139.46 14.56 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.84 -0.695 . . . . 63.13 112.519 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -150.89 90.35 4.19 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 120.656 0.265 . . . . 72.22 110.621 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -61.86 -22.57 74.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.523 2.149 . . . . 73.32 112.668 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.65 -42.18 64.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.86 0.362 . . . . 72.14 110.889 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -97.59 25.76 5.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.064 -0.516 . . . . 74.22 111.358 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 54.71 32.45 17.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.344 -0.389 . . . . 73.53 111.16 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . . . . . . . . . 20.2 mm -95.72 111.79 56.96 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 73.44 111.118 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.23 171.46 11.48 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.34 2.027 . . . . 75.1 112.171 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -68.72 122.17 9.1 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.535 2.157 . . . . 61.41 112.314 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 71.42 34.47 1.7 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.214 -0.448 . . . . 75.04 110.988 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -83.86 147.38 27.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.046 0.45 . . . . 74.44 111.768 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.62 148.05 24.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.776 -0.647 . . . . 61.01 110.367 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 5.5 mt -130.03 109.11 10.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.883 0.373 . . . . 71.22 111.767 -179.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 50.3 m -111.3 141.45 44.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.109 -0.496 . . . . 75.34 110.612 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.54 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 11.6 p90 -153.96 178.17 10.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.107 0.48 . . . . 70.23 111.717 -179.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -127.9 132.13 49.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.604 -0.725 . . . . 70.41 110.123 179.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 2.4 t -120.8 149.04 23.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.121 0.486 . . . . 72.43 112.034 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -136.73 109.85 7.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.584 -0.734 . . . . 75.14 110.253 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 3.2 tt -69.92 134.33 48.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.342 -0.39 . . . . 74.41 110.89 -179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 40.4 t -112.08 -29.96 2.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.252 -0.431 . . . . 73.05 111.392 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -168.82 158.71 9.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.821 0.343 . . . . 62.31 111.176 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 35.1 mt -141.62 111.53 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 75.11 111.168 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 75.31 110.841 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 CA--C 1.53 0.19 0 CA-C-O 120.636 0.255 . . . . 71.21 111.086 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.415 ' HD2' ' CE1' ' A' ' 72' ' ' PHE . 90.2 Cg_endo -80.7 146.15 16.59 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.813 2.342 . . . . 75.15 112.469 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -84.34 152.21 24.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 75.22 110.743 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 mpp_? -52.4 121.31 6.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 74.1 111.116 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -93.78 -13.05 27.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 72.22 111.376 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.469 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 1.2 m-90 -137.12 173.73 11.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.877 0.37 . . . . 74.24 110.681 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 m -117.11 151.36 36.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.06 -0.518 . . . . 70.33 110.58 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.4 t -57.18 -33.17 42.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.065 0.46 . . . . 75.13 110.364 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.53 -28.25 61.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.696 -0.684 . . . . 74.44 111.058 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -82.06 -57.75 3.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.323 -0.399 . . . . 74.41 110.994 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.5 mt -50.32 -62.24 1.7 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.198 -0.456 . . . . 74.31 111.092 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.0 mtt180 -54.37 -24.35 19.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 74.11 111.268 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.98 173.69 0.31 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.334 -0.394 . . . . 65.44 111.082 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.32 16.35 21.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 72.44 111.237 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -107.73 -25.32 11.33 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.547 -0.297 . . . . 74.42 111.011 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.469 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 10.3 tt -86.13 129.48 53.69 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.293 -0.412 . . . . 73.21 110.874 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.29 123.14 9.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.332 2.021 . . . . 64.12 112.32 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -24.06 66.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.22 111.211 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.9 mmtp -53.38 -39.31 64.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.396 -0.365 . . . . 74.31 111.396 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -79.02 -29.04 43.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.324 -0.398 . . . . 73.4 111.209 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.42 HD12 HG21 ' A' ' 25' ' ' ILE . 49.0 mt -66.18 -37.12 79.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.32 -0.4 . . . . 65.34 111.096 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 10.3 mt -72.53 -44.47 61.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 73.11 110.938 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -59.53 -24.17 63.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.847 -0.615 . . . . 73.12 111.026 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -74.87 -50.08 18.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 73.21 110.894 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.1 mt -65.13 -40.69 94.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.963 -0.562 . . . . 74.44 110.919 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -67.89 -23.73 65.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.219 -0.446 . . . . 74.31 110.492 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -88.03 -48.21 7.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.086 -0.506 . . . . 75.55 110.885 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -97.23 16.44 19.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 74.34 111.307 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -131.34 151.93 19.86 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.661 -0.781 . . . . 73.22 112.408 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.83 154.05 19.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.685 0.279 . . . . 73.04 110.618 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -46.98 -52.67 14.14 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.527 -0.306 . . . . 74.43 111.337 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 57.8 m -53.01 -46.54 68.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.012 0.434 . . . . 63.11 110.68 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.444 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 11.2 t80 -56.6 -48.25 77.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.785 -0.643 . . . . 75.31 110.726 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.439 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 13.4 mt -63.46 -45.2 91.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 74.3 110.889 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.07 -34.01 8.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 71.2 111.155 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -59.22 -55.39 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.996 -0.547 . . . . 71.13 111.025 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 -95.59 15.29 20.25 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.175 -0.466 . . . . 75.11 111.411 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 mttp 60.08 38.24 20.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.736 0.303 . . . . 72.53 111.182 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.419 ' HB2' ' HB3' ' A' ' 38' ' ' LEU . 14.3 mt -85.12 -21.76 29.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.373 -0.376 . . . . 63.24 110.796 179.637 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.439 ' N ' ' HB3' ' A' ' 38' ' ' LEU . 81.2 mt -47.08 170.82 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.175 -0.466 . . . . 75.33 111.344 179.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.71 -148.95 20.2 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.913 -0.661 . . . . 62.24 112.869 179.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -114.85 149.16 37.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.005 0.431 . . . . 74.32 111.16 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mp -45.62 -42.03 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.847 -0.615 . . . . 60.31 111.599 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.21 -43.45 82.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.961 -0.563 . . . . 75.13 111.198 -179.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -85.71 -27.1 25.51 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.076 -0.511 . . . . 74.45 111.292 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.3 t -76.74 -26.2 16.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.386 -0.37 . . . . 73.13 111.441 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.78 -25.39 65.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.442 -0.344 . . . . 50.12 111.366 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.29 -30.54 13.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 74.42 111.103 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -84.05 -19.76 33.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.264 -0.426 . . . . 72.03 111.471 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -117.74 130.13 56.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.865 0.364 . . . . 74.51 111.32 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -78.65 -179.09 6.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 73.01 110.48 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.5 tpmp? -61.4 -58.45 8.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.796 0.332 . . . . 74.3 110.524 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -25.51 67.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.196 -0.456 . . . . 75.44 110.646 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.04 -40.06 94.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.11 0.481 . . . . 74.43 110.214 179.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 15.3 mt -77.07 -30.14 55.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.619 -0.719 . . . . 73.22 111.013 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 17.3 t -79.66 -43.48 23.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.991 0.424 . . . . 75.32 110.737 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 63.7 m -59.32 -34.8 72.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.945 -0.571 . . . . 61.5 110.448 179.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.408 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -82.64 -21.19 35.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.544 . . . . 72.53 110.997 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.4 ' O ' ' CD1' ' A' ' 63' ' ' TYR . 14.2 t80 -83.63 -22.64 32.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.094 -0.503 . . . . 74.43 110.918 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 30.2 m-20 -85.06 -53.88 4.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 74.1 111.401 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.428 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.8 p-80 -62.33 -27.27 68.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.097 -0.501 . . . . 73.44 111.323 -179.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.444 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 3.8 tt -50.82 -40.79 56.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.899 0.38 . . . . 71.45 111.065 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.405 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.6 m-85 -79.05 -40.06 32.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.035 -0.53 . . . . 74.02 110.679 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -64.88 -39.75 94.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.961 -0.563 . . . . 74.32 110.972 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.2 p -88.98 -10.38 47.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.001 -0.545 . . . . 72.5 111.399 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt 53.55 33.21 15.77 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.683 0.277 . . . . 75.04 111.21 179.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -92.42 45.84 1.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 75.32 111.026 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.432 ' CD1' HD21 ' A' ' 66' ' ' LEU . 94.5 m-85 -64.86 171.87 3.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 62.4 110.801 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 33.9 tttt . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.325 -0.398 . . . . 73.31 110.914 179.975 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.43 ' CB ' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.768 0.318 . . . . 73.41 111.048 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.422 ' CE1' ' HB1' ' A' ' 178' ' ' ALA . 29.5 p90 -152.64 151.61 30.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.295 -0.412 . . . . 73.53 110.848 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 74.1 m -122.14 103.54 8.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 74.45 110.857 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.9 ttpt -95.92 145.52 25.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.328 -0.397 . . . . 73.1 111.11 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.7 m -138.35 117.78 12.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 72.33 110.727 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 22.8 t -81.07 106.36 12.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.294 -0.412 . . . . 64.45 111.267 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.23 -42.0 19.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 74.32 110.67 179.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -125.05 107.72 11.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 65.31 110.927 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.1 mtmp? -63.64 139.29 58.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 73.22 110.953 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -112.67 -155.02 12.09 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.779 -0.724 . . . . 65.01 112.279 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -33.59 -50.46 0.34 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.917 0.389 . . . . 63.24 111.705 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.1 tttt 71.65 35.64 1.39 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.028 -0.533 . . . . 74.4 110.177 -179.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 75.0 m -163.62 -43.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.664 -0.698 . . . . 73.12 110.525 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -85.3 88.63 7.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.048 -0.524 . . . . 74.45 110.713 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -104.6 155.14 37.85 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 72.41 110.763 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -69.49 125.55 12.41 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.433 2.089 . . . . 62.32 112.436 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -95.46 152.29 18.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.007 -0.542 . . . . 74.43 110.9 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.99 116.95 3.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.278 -0.419 . . . . 73.45 110.981 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 100.59 -26.99 22.52 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.73 -0.748 . . . . 75.33 112.519 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -73.13 137.62 45.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.835 0.35 . . . . 71.05 110.905 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.416 HG12 ' N ' ' A' ' 131' ' ' VAL . 1.2 t -71.16 163.65 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 74.14 110.944 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.55 ' O ' ' HA ' ' A' ' 163' ' ' SER . 2.8 m -153.77 145.27 14.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.038 -0.528 . . . . 74.43 110.884 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.449 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.3 OUTLIER -127.18 117.72 22.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.708 0.289 . . . . 75.13 110.658 179.591 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . 0.415 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 28.4 p -153.23 167.64 28.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.965 0.412 . . . . 73.25 111.15 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.42 ' CE2' ' HG3' ' A' ' 161' ' ' PRO . 8.4 m95 -102.64 162.98 12.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.928 -0.578 . . . . 73.22 110.067 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.46 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 46.3 p90 -162.3 138.4 7.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.078 0.466 . . . . 74.34 111.667 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.49 112.64 15.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.674 -0.694 . . . . 73.04 110.477 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.572 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.5 143.7 16.87 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.619 -0.801 . . . . 60.02 113.001 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -151.47 139.01 19.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.758 0.313 . . . . 73.54 110.539 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 70.8 mt -72.0 -178.58 2.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.288 -0.415 . . . . 70.13 111.031 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -58.3 -42.32 86.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 73.11 110.752 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.87 -4.41 40.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.927 -0.579 . . . . 73.45 111.418 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 90.68 21.73 36.04 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.674 -0.774 . . . . 72.14 112.726 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -90.66 109.12 20.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.8 0.333 . . . . 61.22 110.686 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.1 m -63.58 139.93 20.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 73.35 111.165 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 33.7 p90 -118.85 -40.53 2.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.055 -0.52 . . . . 64.04 111.071 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -155.17 119.98 4.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.074 -0.512 . . . . 71.41 110.727 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 3.5 t -142.82 129.39 20.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.279 -0.419 . . . . 73.44 111.327 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . 0.46 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 26.3 t30 -93.62 46.65 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 72.41 110.435 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.409 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 17.6 mm . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 115.923 -0.581 . . . . 72.03 110.905 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.807 0.337 . . . . 61.2 111.129 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 5.7 tttm -138.69 120.36 10.26 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 75.34 110.863 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . 0.42 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 43.7 Cg_exo -56.33 150.96 47.11 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.378 2.052 . . . . 64.22 112.28 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 5.5 tt -74.17 121.73 21.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 74.54 110.563 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.55 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.1 OUTLIER -99.29 120.36 39.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.94 0.4 . . . . 72.23 111.11 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -148.47 140.66 24.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.045 -0.525 . . . . 75.51 110.455 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -80.19 139.1 36.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.066 0.46 . . . . 74.22 111.192 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.8 m -87.77 149.17 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.738 -0.664 . . . . 73.13 111.16 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.53 21.92 78.68 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.831 -0.7 . . . . 71.31 112.822 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 16.0 m -128.0 41.68 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.881 0.372 . . . . 74.21 111.18 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 41.21 38.19 1.8 Allowed Glycine 0 C--N 1.332 0.356 0 CA-C-N 115.975 -0.557 . . . . 71.15 113.403 179.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 6.8 mtpp -87.38 -39.95 14.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.807 0.337 . . . . 74.32 111.077 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . 0.409 HG13 ' CE3' ' A' ' 175' ' ' TRP . 1.5 m -119.03 177.13 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.205 -0.452 . . . . 75.44 110.925 179.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.5 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.42 158.6 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.339 -0.391 . . . . 75.24 111.331 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -67.34 -26.75 66.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.096 -0.502 . . . . 72.55 111.072 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.46 -37.07 36.77 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.615 -0.802 . . . . 74.33 112.087 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.5 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.5 t90 -78.2 -33.72 49.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.965 0.412 . . . . 75.32 111.044 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -64.65 -36.56 84.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.99 -0.55 . . . . 74.11 110.525 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -75.5 -29.58 59.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.025 -0.534 . . . . 73.4 110.648 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . 0.422 ' HB1' ' CE1' ' A' ' 111' ' ' TYR . . . -81.46 -46.5 14.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 64.44 111.125 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.463 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 10.6 mt -70.67 -18.97 62.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.977 -0.556 . . . . 73.24 111.117 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 2.2 tp -55.31 -23.06 21.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.453 -0.34 . . . . 74.11 111.453 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 27.0 p -115.95 19.92 14.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.588 -0.278 . . . . 74.23 111.565 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 2.2 mmt -66.17 108.15 2.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.843 0.354 . . . . 71.43 110.89 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.78 145.23 43.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 73.53 110.853 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.67 115.53 2.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 73.3 111.191 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 76.61 21.88 73.8 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.967 -0.635 . . . . 73.33 113.002 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -98.38 144.56 27.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.875 0.369 . . . . 72.52 111.201 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 10.6 ttpt -117.1 139.09 51.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.04 -0.527 . . . . 73.22 110.077 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.64 174.34 11.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.177 0.513 . . . . 62.11 112.0 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.54 107.35 6.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.478 -0.783 . . . . 74.31 109.701 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.425 ' HG ' ' CE1' ' A' ' 216' ' ' PHE . 1.0 OUTLIER -120.16 142.06 49.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.184 0.516 . . . . 73.35 112.105 -178.855 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.32 119.72 37.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.54 -0.755 . . . . 73.11 110.112 179.272 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -98.26 151.29 4.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.911 0.386 . . . . 74.31 111.173 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -86.76 165.14 34.0 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.518 . . . . 65.33 110.715 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -62.12 -42.19 31.0 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.492 2.128 . . . . 73.12 112.246 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -59.0 -39.0 80.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.265 -0.425 . . . . 74.13 111.066 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . 0.43 ' CD2' ' CB ' ' A' ' 110' ' ' LYS . 8.9 m0 -97.6 36.94 1.43 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.324 -0.398 . . . . 75.34 110.985 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -162.75 -77.55 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.444 . . . . 74.44 110.749 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.455 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 23.0 m-85 -105.12 -71.22 0.75 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 72.0 110.516 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.21 175.46 14.1 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.873 -0.68 . . . . 74.53 112.845 179.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -26.38 63.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.782 0.325 . . . . 74.44 110.983 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -67.43 -52.61 37.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.976 0.417 . . . . 74.33 110.776 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 102.33 168.33 26.79 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.87 -0.681 . . . . 73.51 112.515 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . 0.419 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.5 OUTLIER -107.43 91.63 7.26 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.657 0.265 . . . . 74.4 110.791 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -66.95 -21.03 50.51 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.462 2.108 . . . . 75.52 112.477 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.05 -42.05 98.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.873 0.368 . . . . 72.21 110.949 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -105.92 31.18 5.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.102 -0.499 . . . . 72.32 111.15 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 30.9 mttt 54.33 28.28 9.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 74.02 111.039 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . 0.434 HD12 ' CE2' ' A' ' 198' ' ' TYR . 60.1 mt -89.07 113.55 56.64 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 73.41 110.966 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.26 171.5 11.45 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.447 2.098 . . . . 62.11 112.458 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.44 152.62 70.99 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.606 2.204 . . . . 74.51 112.378 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 46.4 32.14 1.48 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.19 -0.459 . . . . 74.41 111.228 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -79.9 144.29 33.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 75.13 111.483 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 18.5 tttt -89.55 144.72 25.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.938 -0.574 . . . . 74.31 110.258 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.455 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 8.0 mt -127.0 108.88 11.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.876 0.369 . . . . 75.52 111.7 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 56.2 m -109.67 143.18 39.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 71.11 110.501 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.572 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 15.0 p90 -156.05 178.38 10.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.108 0.48 . . . . 65.22 111.336 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -134.3 137.71 44.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.667 -0.697 . . . . 71.32 110.314 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 2.1 t -123.71 151.95 28.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.018 0.437 . . . . 74.14 111.876 -178.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -136.74 110.42 8.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.793 -0.639 . . . . 74.45 110.27 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . 0.415 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.47 132.81 46.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.426 -0.352 . . . . 74.44 110.758 -179.584 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 20.6 t -111.11 -31.45 2.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.279 -0.419 . . . . 64.42 111.469 -179.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -170.66 161.97 7.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.904 0.383 . . . . 71.4 110.983 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 4.2 mp -139.48 109.61 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 72.55 111.058 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 75.0 110.906 179.977 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 57.3 t . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.607 0.241 . . . . 73.33 111.062 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.425 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 98.3 Cg_endo -85.92 149.78 9.65 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 123.007 2.471 . . . . 73.34 112.552 -179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.43 147.2 27.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 43.21 110.972 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.28 99.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 74.13 111.234 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.42 -18.35 61.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 74.32 111.268 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.418 ' CH2' ' HB3' ' A' ' 24' ' ' ASP . 2.2 m-90 -131.81 173.35 11.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.865 0.364 . . . . 71.52 110.737 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.74 153.64 27.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.108 -0.496 . . . . 74.44 110.452 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 33.6 t -54.75 -35.01 31.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.983 0.42 . . . . 75.45 110.817 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.44 -34.32 78.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.985 -0.552 . . . . 71.43 111.069 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.5 -55.43 5.22 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.798 0.332 . . . . 75.22 111.044 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.2 mt -50.7 -30.76 14.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.993 0.425 . . . . 74.04 110.855 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 47.7 mtt180 -90.95 -28.77 17.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.829 -0.623 . . . . 75.31 110.397 179.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 31.0 t -49.37 176.0 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.901 -0.591 . . . . 74.24 111.484 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -110.37 17.41 20.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.746 -0.661 . . . . 74.41 111.234 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -117.67 -16.45 10.06 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.63 -0.259 . . . . 75.51 111.495 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 tt -87.72 112.49 49.07 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-O 120.55 0.214 . . . . 74.43 111.028 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.09 125.35 17.87 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.478 2.119 . . . . 64.22 112.182 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -24.23 62.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.444 . . . . 64.43 111.161 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -55.07 -43.64 74.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.366 -0.379 . . . . 73.53 111.474 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.418 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 1.5 m-20 -69.32 -54.8 12.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.27 -0.423 . . . . 74.51 111.202 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 41.1 mt -46.36 -33.25 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.929 -0.578 . . . . 72.23 111.422 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 8.2 mt -77.78 -38.03 24.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.315 -0.402 . . . . 73.41 111.033 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -67.11 -23.15 65.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.11 -0.495 . . . . 75.35 111.102 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -77.37 -49.8 14.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.036 0.446 . . . . 74.45 110.92 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.5 mt -61.77 -21.42 64.54 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.747 -0.661 . . . . 73.41 111.185 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -81.5 -58.72 2.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.99 0.424 . . . . 75.24 110.945 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -63.72 -37.45 87.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.844 -0.616 . . . . 75.34 111.746 -179.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.425 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 14.4 m170 -94.57 -7.9 39.75 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.764 0.283 . . . . 73.1 111.764 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.46 162.28 12.97 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.581 -0.819 . . . . 53.31 112.419 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.6 p -91.79 148.46 22.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.532 0.206 . . . . 53.3 110.524 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -48.98 -57.08 7.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.803 0.335 . . . . 74.05 111.136 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.8 t -48.1 -50.33 28.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.018 0.437 . . . . 72.22 110.772 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.513 ' CD1' ' HB2' ' A' ' 71' ' ' ARG . 15.9 t80 -54.09 -47.66 71.51 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.804 -0.635 . . . . 73.41 110.468 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 13.5 mt -64.88 -41.7 95.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.944 -0.571 . . . . 71.43 110.754 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.45 ' CB ' HD23 ' A' ' 44' ' ' LEU . . . -47.85 -42.18 25.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.09 0.471 . . . . 73.05 110.889 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -60.53 -28.09 68.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.686 -0.688 . . . . 74.14 110.883 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 -112.56 10.02 19.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.221 -0.445 . . . . 73.13 111.131 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.91 36.2 17.72 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.801 0.334 . . . . 73.11 110.987 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.6 mt -95.86 -19.79 19.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 74.44 111.756 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.45 HD23 ' CB ' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -77.13 159.66 29.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.077 0.465 . . . . 74.4 111.071 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.05 -122.22 5.56 Favored Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 115.706 -0.679 . . . . 74.0 112.367 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -116.39 119.19 34.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.784 0.326 . . . . 73.43 110.925 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mp -46.07 -52.84 2.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.205 -0.452 . . . . 64.13 111.33 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -48.06 -36.96 13.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.914 -0.585 . . . . 74.53 110.742 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -85.61 -26.1 26.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.874 -0.603 . . . . 74.21 110.884 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.6 t -79.99 -25.97 11.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.289 -0.414 . . . . 72.41 111.331 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.33 -23.75 67.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.386 -0.37 . . . . 73.34 111.102 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -95.28 -28.62 14.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.246 -0.434 . . . . 72.23 110.883 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.5 m -101.99 33.7 2.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 73.25 110.92 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -162.45 126.45 3.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 64.24 110.944 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.72 168.12 14.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.474 . . . . 72.02 110.704 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -58.11 7.93 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.896 0.379 . . . . 75.21 110.505 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.66 -28.56 65.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.144 -0.48 . . . . 74.15 110.187 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.48 96.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.897 -0.592 . . . . 73.3 110.264 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.6 mt -73.41 -32.0 64.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.564 -0.744 . . . . 74.45 110.977 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 33.9 t -78.4 -42.86 26.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.323 -0.399 . . . . 73.15 111.022 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.7 m -60.56 -33.99 73.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.023 -0.535 . . . . 71.24 110.521 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.448 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -82.04 -22.7 36.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.046 -0.524 . . . . 74.23 110.954 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -83.83 -22.81 31.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.142 -0.481 . . . . 74.54 110.989 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -84.15 -54.28 4.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 75.51 111.219 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.457 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.0 p-80 -62.94 -26.22 68.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.987 -0.551 . . . . 74.11 111.18 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.47 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 3.0 tt -48.94 -42.83 38.65 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.951 0.405 . . . . 74.24 110.91 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -79.02 -39.03 35.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.859 -0.609 . . . . 75.4 110.499 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.02 -45.13 96.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.951 -0.568 . . . . 75.51 110.685 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.5 p -89.89 -4.58 57.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.903 -0.589 . . . . 74.42 111.373 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.47 36.46 16.85 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.797 0.332 . . . . 72.24 111.24 179.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.513 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 7.3 mmt180 -88.58 46.05 1.35 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.246 -0.434 . . . . 72.22 111.517 -179.495 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.418 ' CD1' HD23 ' A' ' 66' ' ' LEU . 93.3 m-85 -68.17 173.22 4.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.8 0.333 . . . . 75.43 110.791 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 69.8 tttt . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.28 -0.418 . . . . 73.52 110.899 179.922 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.415 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 4.1 mttt . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.75 0.309 . . . . 74.3 110.945 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.405 ' CE2' ' HB3' ' A' ' 178' ' ' ALA . 39.4 p90 -153.79 160.68 42.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.279 -0.419 . . . . 73.01 110.91 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' THR . . . . . 0.419 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 79.9 m -128.93 103.5 7.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.132 -0.485 . . . . 75.14 110.897 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . 0.401 ' HG2' ' N ' ' A' ' 114' ' ' SER . 5.3 tttt -103.14 144.27 31.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.317 -0.401 . . . . 75.42 111.045 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.401 ' N ' ' HG2' ' A' ' 113' ' ' LYS . 0.3 OUTLIER -139.44 120.36 14.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.161 -0.472 . . . . 73.25 110.905 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 30.6 t -75.36 106.36 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 74.25 111.288 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -80.75 -44.77 18.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 74.24 110.844 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -123.34 107.84 12.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.441 . . . . 75.11 111.049 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.5 mttm -62.44 139.58 58.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 71.22 110.803 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -106.66 -106.27 3.1 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.759 -0.734 . . . . 61.2 112.452 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -90.48 -43.8 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.965 0.412 . . . . 73.04 110.745 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 72.26 38.92 0.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.918 -0.583 . . . . 73.51 110.763 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.4 ' O ' ' CD1' ' A' ' 124' ' ' PHE . 0.8 OUTLIER -160.59 -44.76 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.007 -0.542 . . . . 64.22 110.785 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -85.17 106.32 16.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 75.23 110.873 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.4 ' CD1' ' O ' ' A' ' 122' ' ' THR . 18.2 m-85 -119.22 147.78 43.7 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.186 -0.461 . . . . 75.15 110.885 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.33 127.99 28.19 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.579 2.186 . . . . 73.13 112.303 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.0 mmtm -103.21 147.35 27.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 75.51 110.882 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 11.5 mtpt -55.64 111.25 0.86 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 73.21 111.02 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 107.42 -16.37 37.98 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.759 -0.734 . . . . 74.11 112.693 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.76 136.78 32.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.803 0.335 . . . . 74.12 110.875 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.512 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 23.9 m -70.82 171.88 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.253 -0.43 . . . . 73.33 111.302 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.636 ' O ' ' HA ' ' A' ' 163' ' ' SER . 19.9 m -156.63 145.47 11.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.773 -0.649 . . . . 75.34 110.529 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.451 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.2 117.83 23.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.683 0.278 . . . . 73.03 110.755 179.865 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . 0.511 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.4 p -155.16 169.58 23.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.976 0.417 . . . . 74.33 111.216 -179.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.42 ' CZ2' ' HG3' ' A' ' 161' ' ' PRO . 12.3 m95 -106.36 165.62 11.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.858 -0.61 . . . . 74.34 110.074 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.462 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 39.9 p90 -161.76 136.21 6.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.041 0.448 . . . . 71.54 111.837 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.9 m -122.77 108.8 13.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.728 -0.669 . . . . 73.32 110.19 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.631 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.15 146.02 18.11 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.573 -0.823 . . . . 75.23 113.55 -179.128 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -152.28 152.53 32.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.767 0.318 . . . . 70.32 110.575 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 14.5 mt -87.52 -177.51 5.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 74.44 110.972 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -56.87 -43.44 81.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.103 -0.498 . . . . 65.42 110.939 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.1 -9.77 59.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.997 -0.547 . . . . 71.22 111.249 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 100.91 25.83 8.26 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.669 -0.777 . . . . 72.2 112.52 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.14 108.73 17.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.775 0.321 . . . . 72.13 110.864 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 39.0 t -63.67 126.4 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 74.43 111.111 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.427 ' CE2' ' HA3' ' A' ' 137' ' ' GLY . 51.7 p90 -111.83 -28.63 7.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 75.42 111.106 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -158.47 115.16 2.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.892 0.377 . . . . 74.33 111.084 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 85.5 m -132.9 106.75 7.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 72.12 110.83 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . 0.462 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 36.0 t30 -86.33 6.7 28.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.446 . . . . 72.34 111.552 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.417 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 12.4 mm . . . . . 0 C--N 1.33 -0.24 0 CA-C-O 120.682 0.277 . . . . 74.34 110.661 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.819 0.342 . . . . 73.42 110.994 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -132.09 121.62 17.86 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 74.24 110.855 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . 0.42 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 51.9 Cg_exo -54.67 150.7 34.72 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.396 2.064 . . . . 75.02 112.259 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 3.3 tt -77.89 121.13 23.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.217 -0.447 . . . . 75.5 110.49 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.636 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -99.25 121.73 41.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.945 0.402 . . . . 75.13 111.402 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 14.7 p90 -149.25 141.02 23.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.989 -0.55 . . . . 74.32 110.652 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 36.2 mttp -78.07 138.04 38.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.988 0.423 . . . . 64.41 111.151 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.8 m -87.76 149.12 4.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.84 -0.618 . . . . 71.25 111.157 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.25 24.61 74.81 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.783 -0.723 . . . . 60.21 112.635 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 5.6 m -132.94 43.26 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.867 0.365 . . . . 74.51 111.037 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.2 36.38 5.41 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 121.151 -0.547 . . . . 73.41 113.168 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 2.7 mmtm -82.47 -47.06 12.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.899 0.38 . . . . 75.3 110.997 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . 0.401 HG13 ' CE3' ' A' ' 175' ' ' TRP . 0.4 OUTLIER -119.07 -179.33 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.06 -0.518 . . . . 75.33 110.962 179.847 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.538 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -58.41 160.69 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.375 -0.375 . . . . 74.44 111.265 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -68.95 -27.91 66.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.198 -0.455 . . . . 75.31 111.259 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.21 -37.46 42.37 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.595 -0.812 . . . . 53.14 111.98 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.538 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 1.8 t90 -77.86 -33.15 52.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.985 0.421 . . . . 73.14 111.033 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -63.22 -38.58 91.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.962 -0.563 . . . . 61.01 110.636 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -75.5 -29.37 59.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.988 -0.551 . . . . 72.11 110.824 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . 0.405 ' HB3' ' CE2' ' A' ' 111' ' ' TYR . . . -79.13 -61.94 1.85 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.436 . . . . 73.25 111.32 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.5 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 6.9 mt -53.77 -33.77 56.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.028 -0.533 . . . . 75.14 111.031 -179.753 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 49.3 tp -58.84 -28.17 65.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.368 -0.378 . . . . 74.31 110.825 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 26.4 p -91.75 -2.96 56.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 71.3 111.404 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 1.1 ttp -77.7 156.63 30.55 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.79 0.329 . . . . 74.13 110.797 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -112.79 167.96 10.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 74.12 111.134 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 3.9 tttp -68.16 126.48 29.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.961 -0.563 . . . . 72.41 111.034 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.67 33.14 71.16 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.759 -0.734 . . . . 63.02 112.683 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -118.34 148.76 42.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.793 0.33 . . . . 73.44 110.849 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -117.09 139.75 50.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.297 -0.411 . . . . 74.01 110.213 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -145.65 173.86 11.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.151 0.5 . . . . 74.42 111.866 -179.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.75 114.93 10.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.585 -0.734 . . . . 73.44 109.71 179.183 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.424 ' HG ' ' CE1' ' A' ' 216' ' ' PHE . 0.9 OUTLIER -126.11 141.87 51.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.501 . . . . 62.14 112.131 -178.948 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.76 112.89 21.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.556 -0.747 . . . . 75.12 110.236 179.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.456 ' CD1' ' CZ ' ' A' ' 216' ' ' PHE . 3.7 mp -101.09 143.48 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.971 0.415 . . . . 75.42 111.637 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.414 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.1 mt-10 -79.99 167.71 31.54 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 73.41 110.59 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . 0.414 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 18.8 Cg_endo -60.36 -44.03 30.55 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.45 2.1 . . . . 71.1 112.257 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.03 -25.27 11.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 73.23 111.296 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . 0.415 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 7.4 m0 -118.02 36.95 4.13 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.472 -0.331 . . . . 74.33 111.097 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -155.25 -83.59 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 62.02 111.357 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.441 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 35.6 m-85 -105.59 -27.91 11.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.898 0.38 . . . . 75.15 110.84 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 105.38 176.8 24.22 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.832 -0.699 . . . . 74.2 112.789 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -60.23 -34.65 73.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.79 0.328 . . . . 75.53 110.858 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -49.49 77.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 73.24 110.707 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.34 -158.65 14.21 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.839 -0.696 . . . . 71.12 112.605 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . 0.428 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.0 OUTLIER -149.77 83.64 6.23 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 120.82 0.343 . . . . 63.14 110.518 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.39 -43.6 43.35 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.725 2.284 . . . . 75.5 112.727 -179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.64 -42.13 70.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.889 0.376 . . . . 71.44 111.036 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -96.95 26.73 4.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.043 -0.526 . . . . 65.42 111.299 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.19 31.13 4.8 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.405 -0.361 . . . . 72.33 111.091 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . 0.423 HG13 ' CE2' ' A' ' 198' ' ' TYR . 18.5 mm -95.72 111.72 56.71 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 74.22 111.19 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.29 161.3 43.19 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.407 2.071 . . . . 64.02 112.214 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_exo -51.62 118.62 4.6 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.489 2.126 . . . . 74.33 112.292 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 65.07 72.5 0.43 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.226 -0.443 . . . . 72.54 110.849 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -122.33 151.64 40.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 72.34 111.256 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 5.6 tptt -88.7 148.12 24.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.074 -0.512 . . . . 74.2 110.45 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.441 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 8.2 mt -129.86 109.41 10.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.839 0.352 . . . . 73.45 111.363 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 58.5 m -106.97 138.92 42.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.062 -0.517 . . . . 74.42 110.786 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.631 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 9.0 p90 -161.8 -175.4 4.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.265 -0.425 . . . . 64.35 111.053 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.65 147.96 33.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 73.32 110.807 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 1.5 t -125.89 153.36 33.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.98 -0.555 . . . . 71.13 112.025 -178.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -133.93 106.11 7.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.846 -0.615 . . . . 75.24 110.031 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . 0.511 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 1.3 tt -69.93 130.97 43.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.406 -0.361 . . . . 62.4 110.996 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . 0.402 ' N ' HD23 ' A' ' 220' ' ' LEU . 28.1 t -109.3 -29.72 2.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.17 -0.468 . . . . 75.22 111.466 -179.708 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -171.11 161.67 6.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.869 0.366 . . . . 74.2 111.267 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 39.3 mt -141.96 111.45 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.087 -0.506 . . . . 74.04 110.99 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 74.4 110.899 179.979 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.1 t . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.653 0.263 . . . . 73.14 111.063 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.446 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 72.0 Cg_endo -77.18 137.75 17.38 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.708 2.272 . . . . 75.21 112.456 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -82.35 148.1 28.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 72.44 110.76 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.89 97.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 74.34 111.207 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.95 -16.36 63.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.482 . . . . 75.42 111.397 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.429 ' CZ3' ' HA ' ' A' ' 25' ' ' ILE . 4.1 m-90 -129.44 161.87 29.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.948 0.404 . . . . 74.42 110.812 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.5 m -100.48 150.02 23.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.873 -0.603 . . . . 71.3 110.148 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.453 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 46.3 t -56.85 -36.84 51.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.958 0.409 . . . . 62.24 110.47 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 17' ' ' SER . 3.7 pt-20 -69.1 -22.71 63.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.814 -0.63 . . . . 73.0 110.852 179.366 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 17' ' ' SER . 26.0 mt-30 -82.03 -54.49 5.26 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.358 -0.383 . . . . 75.53 111.174 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.1 mt -50.11 -66.38 0.4 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 71.2 111.782 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 12' ' ' VAL . 2.5 ptm180 -59.4 -25.23 64.12 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 120.957 -0.297 . . . . 75.31 111.242 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.425 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 0.2 OUTLIER -52.03 179.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.919 0.39 . . . . 71.31 111.144 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -110.36 16.43 21.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.055 -0.521 . . . . 73.32 111.199 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.85 -23.75 8.48 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.497 -0.32 . . . . 74.42 111.184 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -80.67 117.2 66.78 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.454 -0.339 . . . . 74.12 110.856 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.85 123.65 11.62 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.466 2.11 . . . . 72.22 112.425 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -27.82 69.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.112 -0.495 . . . . 72.34 111.278 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -53.47 -39.51 64.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.909 0.385 . . . . 75.42 111.122 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.53 -53.65 9.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.059 -0.519 . . . . 73.24 110.658 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.45 HG21 HD11 ' A' ' 25' ' ' ILE . 36.2 mt -45.63 -33.63 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.799 -0.637 . . . . 74.12 111.342 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 6.0 mt -76.02 -40.21 37.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 65.21 111.037 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -69.43 -23.53 63.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.03 -0.532 . . . . 73.45 111.263 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.451 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 22.9 t80 -74.84 -46.4 36.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.964 0.411 . . . . 75.52 111.124 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.5 mt -69.03 -24.67 64.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.963 -0.562 . . . . 74.51 111.185 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -80.2 -28.37 38.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.387 -0.37 . . . . 73.14 110.98 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -94.29 -41.06 9.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.297 -0.41 . . . . 64.31 111.113 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.451 ' ND1' ' CZ ' ' A' ' 28' ' ' PHE . 11.7 m170 -90.3 -7.32 53.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.301 -0.408 . . . . 75.35 111.477 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.8 164.83 12.99 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.698 -0.763 . . . . 53.22 112.401 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.3 p -92.43 148.39 22.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.671 0.272 . . . . 74.25 110.614 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -48.66 -57.08 6.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.785 0.326 . . . . 72.24 111.012 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.65 -50.72 31.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 74.24 110.706 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.511 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 19.8 t80 -53.78 -47.97 70.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.751 -0.659 . . . . 75.41 110.287 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 14.9 mt -63.83 -41.57 97.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.901 -0.591 . . . . 73.52 110.763 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -47.55 -40.21 18.35 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.2 -0.455 . . . . 72.14 111.095 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -48.59 -48.78 38.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.864 -0.607 . . . . 75.12 110.972 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -103.45 13.64 33.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 75.12 111.223 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 58.17 43.38 20.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.837 0.351 . . . . 71.02 110.894 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 20.4 mt -95.22 -20.91 18.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 74.55 111.615 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.97 158.32 32.1 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.007 0.432 . . . . 63.2 111.127 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.76 -124.23 6.1 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.978 -0.629 . . . . 73.44 112.42 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -116.3 121.18 41.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.783 0.325 . . . . 74.01 110.945 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.4 mp -46.76 -50.53 5.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.223 -0.444 . . . . 73.45 111.335 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mttm -50.41 -38.64 43.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.923 -0.581 . . . . 74.3 110.753 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -85.57 -26.3 26.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.881 -0.599 . . . . 74.2 110.9 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.0 t -79.2 -26.22 12.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.28 -0.418 . . . . 74.22 111.313 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.01 -23.34 67.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.399 -0.364 . . . . 74.23 111.123 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -95.22 -28.06 15.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 74.21 110.9 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.02 33.64 2.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 72.4 110.918 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -159.54 124.51 4.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 51.14 110.962 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -83.85 171.09 13.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 71.4 110.755 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.27 -57.92 9.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.391 . . . . 75.21 110.599 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.32 -26.19 67.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.985 -0.552 . . . . 63.35 110.435 179.338 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -45.18 93.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.995 -0.548 . . . . 74.21 110.492 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.6 mt -74.68 -29.14 61.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.695 -0.684 . . . . 73.15 111.101 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 5.9 t -79.71 -43.52 23.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.972 0.415 . . . . 64.24 110.885 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.7 m -61.0 -34.99 75.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.911 -0.586 . . . . 72.31 110.761 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.437 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -81.33 -23.39 37.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 72.3 111.073 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -83.74 -22.79 31.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 74.32 110.945 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.1 m-20 -83.42 -54.61 4.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 73.24 111.39 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.511 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.3 p-80 -62.59 -25.79 68.26 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.114 -0.494 . . . . 65.32 111.327 -179.411 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.441 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.0 tt -53.25 -40.07 64.32 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.877 0.37 . . . . 71.41 110.935 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -78.71 -38.93 37.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.029 -0.532 . . . . 73.11 110.621 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.86 -41.26 91.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.023 -0.535 . . . . 73.4 110.772 179.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.9 p -90.85 -4.14 56.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.938 -0.574 . . . . 71.34 111.437 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.98 37.93 11.38 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.735 0.302 . . . . 73.34 111.351 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.407 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 27.0 mtt-85 -94.13 44.1 1.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.383 -0.371 . . . . 74.42 111.092 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.439 ' CD2' HD22 ' A' ' 66' ' ' LEU . 86.0 m-85 -64.32 177.75 0.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 71.23 110.832 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.3 tttt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 73.24 110.913 179.913 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.418 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 1.8 mptt . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.857 0.36 . . . . 74.14 110.957 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.409 ' CE1' ' HB2' ' A' ' 177' ' ' GLU . 34.3 p90 -151.99 152.36 32.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.207 -0.451 . . . . 73.23 110.886 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 62.9 m -124.08 103.62 8.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 62.03 110.947 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt -97.09 151.34 19.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.445 . . . . 75.24 110.834 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.403 ' O ' ' CD2' ' A' ' 116' ' ' LEU . 1.4 t -148.69 118.62 7.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.248 -0.433 . . . . 72.34 111.018 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 40.7 t -78.62 106.33 9.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.461 . . . . 72.11 111.242 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.403 ' CD2' ' O ' ' A' ' 114' ' ' SER . 3.2 mm? -81.8 -41.26 21.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.419 . . . . 75.21 110.7 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 8.2 ttpp -125.51 109.15 12.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 75.11 111.008 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.4 mttp -61.14 139.44 58.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 74.44 110.937 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -97.33 -108.3 2.59 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.802 -0.713 . . . . 65.51 112.478 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -96.42 -37.32 10.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.967 0.413 . . . . 73.51 110.7 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.4 36.87 0.61 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.885 -0.598 . . . . 74.42 110.911 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 58.8 m -163.09 -43.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 71.34 111.086 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -81.81 86.05 6.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.286 -0.416 . . . . 74.32 111.158 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -102.74 143.36 26.45 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 75.42 110.743 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.51 130.96 43.36 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.559 2.173 . . . . 74.51 112.575 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.12 147.31 24.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 72.55 110.735 179.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -53.3 116.94 2.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.329 -0.396 . . . . 75.52 111.139 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 93.8 -4.27 71.86 Favored Glycine 0 CA--C 1.519 0.326 0 C-N-CA 120.732 -0.747 . . . . 73.52 112.876 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.21 139.5 30.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.869 0.366 . . . . 70.0 110.972 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.432 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 7.8 p -69.39 162.23 3.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 72.43 111.055 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.614 ' O ' ' HA ' ' A' ' 163' ' ' SER . 13.4 m -154.86 145.95 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 73.13 111.031 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.463 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -128.08 117.97 22.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.722 0.296 . . . . 75.24 110.951 179.909 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . 0.408 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 22.9 p -151.36 166.76 30.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.92 0.39 . . . . 75.24 111.216 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.429 ' CE2' ' HG3' ' A' ' 161' ' ' PRO . 15.8 m95 -100.93 160.9 13.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.017 -0.538 . . . . 71.43 109.961 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.463 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 17.4 p90 -161.28 138.1 8.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.917 0.389 . . . . 74.31 111.632 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 3.5 m -126.33 109.06 11.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.999 -0.546 . . . . 74.43 111.043 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.702 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -86.94 138.31 15.41 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.834 -0.698 . . . . 73.1 113.111 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.98 132.56 14.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.705 0.288 . . . . 73.4 110.522 179.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 40.8 mt -70.44 -178.37 1.73 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.381 -0.372 . . . . 74.03 110.991 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -57.15 -42.71 81.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.086 -0.507 . . . . 61.21 110.774 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -76.03 -3.08 33.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.935 -0.575 . . . . 71.12 111.493 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 90.67 8.39 65.63 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.629 -0.796 . . . . 74.2 112.91 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.01 110.01 11.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.785 0.326 . . . . 73.13 110.684 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 7.3 p -63.67 133.04 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.289 -0.414 . . . . 73.21 111.158 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.415 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 46.1 p90 -111.22 -29.3 7.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 72.03 110.832 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -168.21 121.8 0.9 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 70.51 110.866 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 12.5 t -142.82 128.25 18.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.37 -0.377 . . . . 74.15 111.077 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . 0.463 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 27.3 t30 -89.14 53.29 2.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.096 -0.502 . . . . 71.4 110.631 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . 3.2 mt . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 74.45 111.394 179.964 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.802 0.334 . . . . 42.21 111.116 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 161' ' ' PRO . 23.4 mttm -138.52 134.69 17.54 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 74.11 110.776 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . 0.429 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 31.1 Cg_exo -58.76 152.18 58.7 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.378 2.052 . . . . 64.45 112.351 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.62 125.56 29.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 72.13 110.306 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.614 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.66 122.91 43.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.991 0.424 . . . . 73.44 111.585 -179.66 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -151.31 143.62 24.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.859 -0.609 . . . . 74.32 110.516 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 34.6 mttt -81.7 142.0 33.08 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 75.33 111.043 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.5 m -87.69 149.03 4.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.897 -0.592 . . . . 74.33 111.285 -179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 67.91 25.11 74.36 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.851 -0.69 . . . . 70.52 112.592 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 27.3 m -131.3 41.11 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.788 0.327 . . . . 75.43 111.174 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.22 35.25 2.49 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 121.194 -0.527 . . . . 73.23 113.151 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.69 -43.55 15.43 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.794 0.331 . . . . 74.13 111.178 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.8 m -119.14 179.38 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.166 -0.47 . . . . 61.44 111.147 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.527 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.4 163.61 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 73.41 111.217 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . 0.419 ' HD3' ' CZ2' ' A' ' 196' ' ' TRP . 14.7 ttm105 -70.13 -29.75 66.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.234 -0.439 . . . . 74.3 111.227 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.36 -36.49 49.86 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.603 -0.808 . . . . 74.12 112.02 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.527 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 1.7 t90 -79.76 -34.34 39.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.052 0.453 . . . . 74.02 110.874 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -62.82 -33.28 74.9 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.751 -0.659 . . . . 74.0 110.403 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . 0.409 ' HB2' ' CE1' ' A' ' 111' ' ' TYR . 3.9 mm-40 -80.77 -29.09 36.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.527 . . . . 71.13 110.68 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -78.8 -61.93 1.86 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.445 . . . . 73.23 111.175 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.468 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 10.1 mt -53.65 -28.14 31.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.967 -0.56 . . . . 64.44 110.794 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.1 tp -53.38 -29.75 36.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.115 -0.493 . . . . 74.3 111.272 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 60.2 p -108.87 7.7 26.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.382 -0.372 . . . . 64.22 111.7 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 26.7 mmm -69.78 106.03 2.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.889 0.376 . . . . 70.33 110.884 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.09 150.25 48.46 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.969 -0.56 . . . . 74.14 111.036 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.12 119.94 6.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.56 . . . . 62.02 110.9 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 74.97 20.33 79.5 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.705 -0.76 . . . . 74.15 112.431 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -96.95 143.41 27.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.846 0.355 . . . . 63.23 111.081 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt -110.45 132.9 53.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.061 -0.518 . . . . 74.33 109.787 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -143.08 171.52 13.96 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.235 0.54 . . . . 74.34 112.09 -179.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . 0.425 ' HA ' ' HA ' ' A' ' 217' ' ' GLU . 0.0 OUTLIER -137.09 117.6 13.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.299 -0.864 . . . . 74.22 109.504 179.587 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.446 ' CD2' ' CE2' ' A' ' 216' ' ' PHE . 2.2 pt? -127.6 141.23 51.68 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.212 -0.595 . . . . 73.44 112.545 -178.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -113.59 116.12 29.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.271 -0.877 . . . . 74.43 109.864 179.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . 0.403 HG12 ' CE1' ' A' ' 216' ' ' PHE . 4.5 mm -91.42 144.81 8.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.857 0.36 . . . . 62.32 111.372 -179.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -84.47 154.49 62.53 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.069 -0.514 . . . . 74.41 110.481 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . 0.415 ' O ' ' N ' ' A' ' 199' ' ' GLY . 63.7 Cg_exo -51.07 -44.2 43.76 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.458 2.105 . . . . 72.42 112.376 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -62.36 -19.74 63.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 74.02 111.629 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . 0.419 ' CZ2' ' HD3' ' A' ' 173' ' ' ARG . 6.3 m0 -118.55 37.1 4.16 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.64 0.257 . . . . 71.5 111.528 -179.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -156.19 -84.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.634 -0.257 . . . . 74.34 111.581 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.454 ' CE2' ' CD1' ' A' ' 208' ' ' ILE . 19.6 m-85 -104.96 -26.19 12.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.853 0.359 . . . . 74.41 111.061 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 194' ' ' PRO . . . 105.85 163.33 23.17 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.833 -0.699 . . . . 70.22 112.474 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 28.7 mtmt -55.49 -30.91 61.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.825 0.345 . . . . 75.53 110.824 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 18.8 mtpt -61.21 -48.53 81.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 73.14 110.795 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 106.72 166.32 22.53 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.836 -0.697 . . . . 40.03 112.487 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . 0.429 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.7 OUTLIER -110.68 90.02 10.0 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.701 0.286 . . . . 75.23 110.832 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.17 -21.59 55.21 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.459 2.106 . . . . 73.54 112.409 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.46 -41.6 85.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.318 -0.401 . . . . 64.42 110.923 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -108.11 27.33 9.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.061 -0.518 . . . . 62.32 111.199 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 56.16 54.44 7.82 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.429 . . . . 74.42 111.108 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . 0.454 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 27.1 mt -117.35 111.63 39.98 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 74.4 111.06 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -60.68 157.76 35.84 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.525 2.15 . . . . 55.41 112.373 -179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.17 130.52 32.67 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.651 2.234 . . . . 75.34 112.142 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 64.09 69.6 0.53 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.337 -0.392 . . . . 74.11 110.873 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -122.87 149.23 44.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.216 -0.447 . . . . 72.33 111.261 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -83.94 149.77 26.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.03 -0.532 . . . . 74.43 110.554 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.453 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 7.2 mt -136.19 109.35 7.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.89 0.376 . . . . 74.02 111.576 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 45.7 m -109.95 138.23 46.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 74.24 110.184 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.702 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 12.4 p90 -157.79 120.36 3.83 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 112.386 0.513 . . . . 75.52 112.386 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 189' ' ' ARG . 2.6 mt-10 -74.17 136.46 42.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.628 -0.714 . . . . 64.23 110.654 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.3 t -122.41 150.89 26.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.077 -0.511 . . . . 75.35 111.525 -178.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -136.77 110.18 7.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.039 -0.528 . . . . 70.34 110.491 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . 0.408 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 3.5 tt -70.53 132.16 45.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.404 -0.362 . . . . 74.3 111.145 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 30.8 t -109.68 -30.69 2.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.103 -0.499 . . . . 64.4 111.429 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -168.94 159.3 9.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.875 0.369 . . . . 75.24 111.107 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 29.2 mt -142.25 112.01 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 71.31 111.157 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 73.33 110.826 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.7 t . . . . . 0 CA--C 1.529 0.151 0 CA-C-O 120.59 0.233 . . . . 65.2 110.84 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.452 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 93.0 Cg_endo -79.21 135.06 11.88 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.533 2.155 . . . . 74.42 112.46 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -80.31 150.63 29.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.181 -0.463 . . . . 75.3 110.803 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.13 96.03 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.184 -0.462 . . . . 75.42 111.209 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.63 -16.46 64.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 74.13 111.396 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 6.0 m-90 -136.0 173.67 11.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.848 0.356 . . . . 73.34 110.789 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -116.79 152.11 35.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.113 -0.494 . . . . 74.13 110.597 179.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.2 t -55.88 -32.74 33.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.264 -0.425 . . . . 75.43 110.928 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -72.33 -26.65 62.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.992 -0.549 . . . . 73.33 111.202 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -82.19 -56.44 3.92 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.842 0.353 . . . . 65.32 111.056 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 mt -49.58 -65.43 0.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.301 -0.409 . . . . 71.21 111.328 -179.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.7 mtp-105 -55.75 -25.09 39.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 73.32 111.356 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.4 -179.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.01 0.434 . . . . 63.15 111.175 -179.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -109.41 16.76 22.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.937 -0.574 . . . . 60.41 111.108 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -114.51 -27.86 7.39 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.485 -0.325 . . . . 75.44 111.097 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -81.94 112.61 36.6 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.392 . . . . 71.4 110.954 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -60.66 123.34 12.82 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.52 2.146 . . . . 65.3 112.364 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -24.15 67.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 75.54 111.192 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -53.61 -40.53 65.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.886 0.374 . . . . 75.41 111.232 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.98 -52.5 14.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.092 -0.504 . . . . 75.01 110.728 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.44 HG23 HD12 ' A' ' 25' ' ' ILE . 42.8 mt -44.87 -30.74 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.707 -0.679 . . . . 74.31 111.295 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.3 mt -81.76 -55.2 8.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.053 0.454 . . . . 74.14 110.765 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -52.44 -27.12 14.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.687 -0.688 . . . . 74.42 110.935 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.454 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 42.7 t80 -77.24 -48.63 17.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.075 -0.511 . . . . 74.21 110.969 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.3 mt -67.13 -26.44 66.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.859 -0.609 . . . . 74.23 111.336 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -75.3 -35.66 61.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.942 0.401 . . . . 74.35 110.717 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.42 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 14.9 pt-20 -87.63 -31.19 19.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 71.33 111.075 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.454 ' ND1' ' CZ ' ' A' ' 28' ' ' PHE . 19.7 m170 -98.95 -9.02 24.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.289 -0.414 . . . . 75.31 111.571 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -109.86 155.65 15.98 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.719 -0.753 . . . . 63.24 112.318 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.3 p -97.3 153.11 18.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.562 0.22 . . . . 71.45 110.539 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.403 ' HA ' HD23 ' A' ' 44' ' ' LEU . 0.8 OUTLIER -42.89 -48.57 5.84 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.847 0.356 . . . . 74.24 111.371 -179.702 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.6 m -52.85 -50.89 62.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.123 -0.489 . . . . 73.34 110.507 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.429 ' CZ ' HD11 ' A' ' 66' ' ' LEU . 1.1 t80 -60.47 -31.95 70.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.623 -0.717 . . . . 73.33 110.355 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.45 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 5.9 mt -75.86 -54.75 6.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.004 -0.543 . . . . 73.03 111.307 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.02 -35.0 23.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.351 -0.386 . . . . 64.43 111.751 -179.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -72.64 -31.13 64.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.242 -0.435 . . . . 71.01 111.523 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.432 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 1.8 m170 -109.91 10.33 24.39 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.734 0.272 . . . . 63.12 111.734 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.407 ' N ' ' O ' ' A' ' 38' ' ' LEU . 7.7 mmmt 58.43 35.63 24.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.745 0.307 . . . . 72.0 111.217 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.413 ' CB ' ' CD2' ' A' ' 38' ' ' LEU . 49.4 mt -90.96 -16.93 27.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.427 -0.352 . . . . 75.31 111.017 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.45 ' N ' ' HB3' ' A' ' 38' ' ' LEU . 56.7 mt -50.76 170.46 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.042 0.449 . . . . 71.43 111.32 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.23 -155.94 29.04 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.927 -0.654 . . . . 63.41 112.951 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 72.9 m-80 -100.57 141.88 32.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.968 0.413 . . . . 74.14 111.051 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 mp -45.31 -47.24 3.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.883 -0.598 . . . . 73.11 111.526 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mttm -51.61 -41.58 61.34 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.983 -0.553 . . . . 71.1 111.065 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -85.7 -28.35 24.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.013 -0.54 . . . . 73.33 111.113 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.3 t -74.0 -27.72 22.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.278 -0.419 . . . . 75.52 111.535 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.45 -24.1 67.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.386 -0.37 . . . . 75.33 111.434 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -95.24 -27.3 15.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.341 -0.391 . . . . 71.51 111.28 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.7 m -84.19 -24.38 30.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.362 -0.381 . . . . 72.24 111.403 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -116.57 132.7 56.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.842 0.354 . . . . 73.44 111.31 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -79.71 -178.61 6.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.126 -0.488 . . . . 72.31 110.409 179.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -60.96 -58.46 8.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.788 0.328 . . . . 73.34 110.494 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.29 -30.18 71.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.211 -0.45 . . . . 75.14 110.512 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.35 -39.64 80.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.5 . . . . 73.03 110.443 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.5 mt -79.36 -27.36 41.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.588 -0.733 . . . . 75.13 111.022 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 10.9 t -79.9 -44.26 22.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.969 0.414 . . . . 63.51 110.774 179.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 79.2 m -60.61 -35.8 77.02 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.896 -0.593 . . . . 70.5 110.236 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.432 ' HA ' ' CE1' ' A' ' 41' ' ' HIS . . . -78.7 -23.19 45.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.855 -0.611 . . . . 75.21 110.774 179.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -82.97 -22.74 33.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.086 -0.506 . . . . 75.41 111.016 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -85.47 -53.73 5.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 75.44 111.242 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -63.33 -24.35 67.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.008 -0.542 . . . . 63.45 111.408 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.442 HD21 ' CD2' ' A' ' 72' ' ' PHE . 6.3 tt -56.06 -39.1 71.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.92 0.39 . . . . 75.41 110.904 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.402 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.4 m-85 -77.85 -40.69 39.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.975 -0.557 . . . . 64.11 110.613 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -66.37 -37.73 85.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.542 . . . . 65.52 110.711 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 75.5 p -91.13 -7.25 52.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.964 -0.562 . . . . 74.42 111.329 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.8 mtmt 51.21 35.43 13.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.739 0.304 . . . . 74.24 111.438 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 41.9 mtt-85 -91.93 44.4 1.17 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.374 -0.375 . . . . 73.42 111.146 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.442 ' CD2' HD21 ' A' ' 66' ' ' LEU . 88.9 m-85 -65.72 176.53 1.51 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.288 -0.414 . . . . 74.41 110.701 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.5 tttt . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 74.24 110.897 179.976 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.794 0.33 . . . . 71.45 110.955 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -154.82 167.33 30.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.285 -0.416 . . . . 73.43 111.015 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 82.0 m -136.72 103.52 5.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.016 -0.538 . . . . 75.51 110.725 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 190' ' ' LEU . 21.5 ptmt -108.14 151.45 25.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.948 0.404 . . . . 73.35 111.196 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -142.49 123.16 14.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.952 -0.567 . . . . 74.32 110.547 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 9.1 p -77.56 106.24 7.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.284 -0.417 . . . . 75.13 111.173 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -77.73 -42.18 35.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 71.13 110.855 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.3 tttm -130.46 108.18 9.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 70.44 110.962 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 138.28 57.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 72.42 110.844 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.5 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -109.22 -156.19 17.01 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.631 -0.795 . . . . 75.22 112.645 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -36.53 -51.21 0.83 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.919 0.39 . . . . 73.43 111.651 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 66.99 34.58 5.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.836 -0.62 . . . . 75.55 110.296 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 55.1 m -151.88 -44.06 0.11 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.697 -0.683 . . . . 72.14 110.66 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -91.5 92.65 8.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 74.43 110.903 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -100.74 153.66 37.61 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 73.35 110.791 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -71.88 125.55 11.12 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.52 2.147 . . . . 70.31 112.443 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.0 mtmm -95.54 156.9 16.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.113 -0.494 . . . . 73.24 110.956 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.8 mttp -57.88 118.71 5.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 74.33 110.865 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 99.24 -23.44 36.29 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.643 -0.789 . . . . 74.33 112.507 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -78.6 136.91 37.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.746 0.308 . . . . 73.11 110.738 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.565 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 17.1 m -73.12 173.46 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.107 0.479 . . . . 73.42 111.655 -179.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.639 ' O ' ' HA ' ' A' ' 163' ' ' SER . 19.4 m -156.78 145.87 11.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.507 -0.769 . . . . 74.51 110.568 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.444 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.3 OUTLIER -126.16 117.72 23.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.639 0.257 . . . . 74.13 110.454 179.506 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 31.9 p -150.8 169.91 20.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.104 0.478 . . . . 63.05 111.512 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' TRP . . . . . 0.488 ' HB3' ' CD1' ' A' ' 149' ' ' ILE . 85.6 m95 -101.88 156.35 17.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.559 -0.746 . . . . 75.11 109.531 179.246 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 31.8 p90 -161.27 137.66 8.34 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 120.314 -0.554 . . . . 74.21 112.304 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 12.8 m -127.88 111.56 13.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.485 -0.779 . . . . 63.41 110.195 179.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . 0.526 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.52 145.54 17.88 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.577 -0.821 . . . . 74.01 113.13 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' THR . . . . . 0.431 ' N ' ' CE2' ' A' ' 145' ' ' PHE . 0.6 OUTLIER -150.71 153.02 34.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.8 0.334 . . . . 70.53 110.893 179.834 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 69.5 mt -92.07 179.23 5.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.01 110.757 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -57.04 -44.4 82.9 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.961 0.41 . . . . 74.13 110.996 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.01 -8.54 56.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.968 -0.56 . . . . 73.42 111.313 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 95.94 25.81 12.47 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.644 -0.789 . . . . 71.21 112.523 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.89 112.59 24.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.836 0.35 . . . . 72.31 110.777 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 4.6 m -63.7 135.08 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 74.34 111.142 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.431 ' CE2' ' N ' ' A' ' 138' ' ' THR . 39.9 p90 -116.27 -39.39 3.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.49 . . . . 72.14 110.882 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -143.41 110.3 5.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.042 -0.526 . . . . 72.52 110.751 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 67.3 m -142.82 107.57 4.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 73.42 111.138 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -97.74 35.42 1.69 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 74.45 110.477 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.488 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 20.2 mm . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.08 -0.509 . . . . 72.44 111.095 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.801 0.334 . . . . 74.11 111.056 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 6.5 mttm -146.38 149.53 37.97 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 73.13 110.959 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.07 155.73 68.16 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.603 2.202 . . . . 75.5 112.223 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.66 123.64 24.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 72.11 110.692 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 163' ' ' SER . . . . . 0.639 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.5 OUTLIER -104.81 124.5 49.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.895 0.378 . . . . 74.21 111.083 179.866 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 164' ' ' PHE . . . . . 0.422 ' CE1' HG23 ' A' ' 171' ' ' VAL . 16.3 p90 -151.26 142.14 22.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 75.13 110.906 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 33.0 mttt -74.24 133.75 42.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.431 . . . . 75.43 111.174 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.0 m -87.76 149.35 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.863 -0.608 . . . . 74.55 111.085 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 69.28 22.07 76.08 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.777 -0.725 . . . . 74.0 112.608 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 11.8 m -132.38 44.16 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.904 0.383 . . . . 60.33 111.059 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.17 36.36 4.02 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.171 -0.537 . . . . 51.2 113.223 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.59 -47.1 14.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.96 0.409 . . . . 73.33 110.881 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 171' ' ' VAL . . . . . 0.422 HG23 ' CE1' ' A' ' 164' ' ' PHE . 0.0 OUTLIER -119.37 -178.66 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.98 -0.554 . . . . 73.11 110.895 179.778 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 172' ' ' ILE . . . . . 0.531 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 4.2 pt -58.16 159.58 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.333 -0.394 . . . . 72.34 111.143 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -68.56 -29.61 68.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.347 -0.388 . . . . 75.44 111.152 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -72.57 -38.39 57.55 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.542 -0.837 . . . . 75.03 111.888 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 175' ' ' TRP . . . . . 0.531 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.0 t90 -77.65 -32.54 53.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.865 0.365 . . . . 75.45 110.94 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -62.61 -34.46 77.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.08 -0.509 . . . . 71.51 110.305 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -78.41 -29.86 47.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.993 -0.549 . . . . 71.31 110.679 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -78.78 -59.07 2.93 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.163 -0.472 . . . . 73.31 111.293 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.471 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 4.6 mt -57.83 -30.78 66.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.986 -0.552 . . . . 75.42 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 34.4 tp -59.47 -31.01 68.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.39 -0.368 . . . . 74.15 110.84 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.86 1.78 56.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 74.13 111.358 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.48 150.43 36.66 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.834 0.349 . . . . 72.22 110.927 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.57 165.63 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.248 -0.433 . . . . 71.34 111.22 -179.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.03 117.93 6.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.998 -0.546 . . . . 64.42 110.764 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 185' ' ' GLY . . . . . 0.405 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 69.35 65.95 2.42 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.678 -0.772 . . . . 75.32 112.272 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 186' ' ' GLU . . . . . 0.5 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 28.0 tt0 -144.48 145.09 31.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.62 0.248 . . . . 75.01 110.403 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt -118.63 137.02 53.57 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.21 -0.293 . . . . 74.21 110.21 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.21 173.79 11.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.18 0.514 . . . . 71.41 111.966 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.73 125.32 22.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.479 -0.782 . . . . 74.52 109.607 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 190' ' ' LEU . . . . . 0.412 ' HA ' ' HA ' ' A' ' 113' ' ' LYS . 1.7 pt? -137.2 143.13 42.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.274 0.559 . . . . 62.14 112.352 -179.122 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -117.13 111.01 18.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.289 -0.868 . . . . 74.45 109.862 179.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 192' ' ' ILE . . . . . . . . . . . . . 23.5 mt -104.76 141.52 20.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.024 0.44 . . . . 74.24 111.657 -179.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -74.02 163.23 69.82 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.758 -0.656 . . . . 75.11 110.947 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 194' ' ' PRO . . . . . 0.404 ' HG3' ' N ' ' A' ' 212' ' ' ALA . 48.7 Cg_exo -56.33 -36.31 96.92 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.756 2.304 . . . . 75.33 112.382 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -57.26 -42.32 81.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.26 -0.427 . . . . 72.52 111.13 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 196' ' ' TRP . . . . . 0.425 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 20.2 m0 -97.58 36.92 1.43 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 75.22 110.933 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -160.24 -79.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.989 -0.55 . . . . 73.41 110.587 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 198' ' ' TYR . . . . . 0.436 ' CE2' HD13 ' A' ' 208' ' ' ILE . 42.6 m-85 -105.86 -71.24 0.75 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 64.13 110.352 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.19 178.13 16.16 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.831 -0.7 . . . . 75.04 112.818 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.27 -33.51 67.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.879 0.371 . . . . 74.44 110.86 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.13 -57.02 14.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.107 -0.497 . . . . 72.42 110.633 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.17 170.19 25.02 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.862 -0.685 . . . . 75.13 112.548 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 203' ' ' GLN . . . . . 0.417 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 2.5 mm-40 -106.48 85.69 1.86 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.726 0.298 . . . . 74.23 110.698 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -63.4 -21.74 71.35 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.572 2.182 . . . . 53.32 112.554 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.59 -42.28 74.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.877 0.37 . . . . 75.35 110.876 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -97.67 28.21 3.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.096 -0.502 . . . . 71.11 111.306 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 56.01 36.51 27.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.394 -0.366 . . . . 73.3 111.013 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 208' ' ' ILE . . . . . 0.436 HD13 ' CE2' ' A' ' 198' ' ' TYR . 40.9 mt -103.94 114.24 64.69 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.151 -0.477 . . . . 72.14 111.045 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.66 171.72 10.41 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.442 2.095 . . . . 75.42 112.364 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.96 128.62 14.25 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.607 2.205 . . . . 72.41 112.426 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 16.9 m-80 64.26 69.79 0.51 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.127 -0.488 . . . . 71.13 111.0 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 212' ' ' ALA . . . . . 0.404 ' N ' ' HG3' ' A' ' 194' ' ' PRO . . . -127.85 124.91 38.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 74.05 111.493 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.19 153.94 39.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 74.55 110.365 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 214' ' ' LEU . . . . . 0.425 HD11 ' CD2' ' A' ' 198' ' ' TYR . 8.5 mt -131.14 109.49 10.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.947 0.403 . . . . 71.24 111.842 -179.264 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 25.4 m -100.99 135.98 41.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 75.2 110.32 179.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 216' ' ' PHE . . . . . 0.526 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 21.1 p90 -153.96 173.46 15.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.112 0.482 . . . . 74.13 111.653 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -132.61 136.37 46.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.637 -0.71 . . . . 72.13 110.426 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 2.1 t -123.83 151.49 28.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.07 0.462 . . . . 72.43 111.968 -178.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -136.83 110.71 8.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.696 -0.683 . . . . 72.41 110.292 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 1.7 tt -70.05 131.08 43.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 72.34 111.102 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 20.1 t -110.34 -29.21 2.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.112 -0.494 . . . . 75.53 111.452 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -170.81 161.31 7.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.917 0.389 . . . . 74.42 111.069 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 42.3 mt -141.02 111.01 3.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.078 -0.51 . . . . 73.33 111.116 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 1.5 t70 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 74.2 110.907 -179.991 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 mtm . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.81 0.338 . . . . 74.21 111.184 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -175.05 96.58 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 74.23 111.092 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -175.29 76.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 70.35 111.089 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -82.57 175.91 9.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 74.12 111.096 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 38.5 t -60.19 111.1 3.47 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 74.33 111.042 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.449 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 76.7 Cg_endo -77.75 137.35 15.98 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.564 2.176 . . . . 74.01 112.36 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -82.41 153.66 25.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 75.31 110.87 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.8 119.91 5.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.219 -0.446 . . . . 63.54 111.072 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.97 -34.22 15.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 65.24 110.988 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.452 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 1.4 m-90 -113.95 173.17 6.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.141 -0.482 . . . . 74.04 110.943 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.1 m -118.4 154.5 32.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.018 -0.537 . . . . 74.51 110.719 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 93.1 t -57.47 -35.52 50.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.939 0.4 . . . . 73.23 110.65 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -70.19 -28.51 65.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 72.34 111.068 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -82.18 -56.79 3.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.871 0.367 . . . . 74.31 111.098 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.6 mt -49.6 -64.59 0.76 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.2 -0.454 . . . . 72.41 111.23 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.04 -25.48 21.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.49 . . . . 73.43 111.182 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.7 173.95 0.08 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.957 0.408 . . . . 73.2 111.313 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -110.37 16.93 21.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.865 -0.607 . . . . 72.12 111.182 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -109.8 -20.83 12.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.544 -0.298 . . . . 75.15 111.218 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.452 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 10.4 tt -91.85 129.78 40.94 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.521 -0.309 . . . . 74.23 110.943 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.89 126.33 11.83 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.396 2.064 . . . . 72.45 112.309 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -24.11 67.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 73.4 111.178 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.0 mmtt -52.84 -39.25 62.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.359 -0.382 . . . . 74.14 111.374 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.39 -57.6 4.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.272 -0.422 . . . . 65.45 111.04 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.457 HD12 HG21 ' A' ' 25' ' ' ILE . 36.2 mt -44.8 -30.67 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.61 . . . . 74.24 111.479 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.1 mt -77.86 -37.33 23.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 74.12 111.008 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -75.37 -24.87 57.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.096 -0.502 . . . . 75.04 111.069 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.489 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 11.8 t80 -72.04 -44.98 62.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.971 0.415 . . . . 63.54 110.837 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.3 mt -68.93 -27.49 65.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 73.53 110.981 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -75.39 -26.57 58.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.271 -0.422 . . . . 74.32 111.127 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.401 ' OE2' ' CD2' ' A' ' 32' ' ' HIS . 0.6 OUTLIER -100.94 -7.2 23.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.413 -0.358 . . . . 71.41 111.317 179.953 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.489 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 10.4 m170 -118.88 -8.73 10.24 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.63 -0.259 . . . . 72.4 111.371 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -123.64 164.74 16.66 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.782 -0.723 . . . . 43.32 112.375 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.7 p -93.21 156.94 16.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.635 0.255 . . . . 74.25 110.535 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -48.18 -55.4 10.5 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.745 0.307 . . . . 74.14 111.086 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.7 m -50.47 -48.14 56.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.023 0.439 . . . . 74.34 110.786 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.471 ' CZ ' ' CD1' ' A' ' 66' ' ' LEU . 1.6 t80 -55.83 -48.66 75.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.842 -0.617 . . . . 75.21 110.44 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.409 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 13.2 mt -66.47 -42.85 86.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.007 -0.542 . . . . 75.52 110.798 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.438 ' CB ' HD22 ' A' ' 44' ' ' LEU . . . -47.39 -41.87 20.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.098 0.475 . . . . 65.31 110.969 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -49.37 -51.44 34.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.623 -0.717 . . . . 74.45 111.062 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -99.95 13.22 34.65 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.98 -0.555 . . . . 70.44 111.287 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt 55.91 41.81 29.54 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.86 0.362 . . . . 74.31 110.862 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 23.3 mt -92.51 -20.45 20.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.073 -0.512 . . . . 73.2 111.491 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.438 HD22 ' CB ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -80.19 157.72 26.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.122 0.487 . . . . 74.34 111.171 -179.741 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.72 -119.9 4.65 Favored Glycine 0 N--CA 1.451 -0.357 0 CA-C-N 115.608 -0.724 . . . . 63.0 112.417 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -116.36 115.14 25.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.72 0.295 . . . . 70.25 110.947 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mp -45.75 -57.22 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.248 -0.433 . . . . 73.12 111.365 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.3 mttt -46.71 -37.23 8.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.87 -0.604 . . . . 71.5 110.944 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -85.7 -26.24 26.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.97 -0.559 . . . . 74.2 111.019 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.6 t -81.21 -26.0 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.411 . . . . 74.14 111.371 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.63 -15.69 63.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.436 -0.347 . . . . 75.44 111.164 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.9 ttpp -95.12 -31.32 13.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.307 -0.406 . . . . 75.33 110.919 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.11 -33.63 17.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 71.12 111.142 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.68 127.25 38.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.264 -0.425 . . . . 70.24 111.163 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -83.49 175.89 9.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 73.55 110.663 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -58.12 9.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.88 0.372 . . . . 75.35 110.595 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.43 -27.81 69.55 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.035 -0.529 . . . . 72.31 110.594 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.1 -43.88 98.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.105 -0.498 . . . . 63.2 110.511 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 21.1 mt -71.59 -34.45 69.9 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.693 -0.685 . . . . 64.12 111.06 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.1 t -76.4 -41.9 35.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.017 0.437 . . . . 74.2 110.922 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.7 m -60.54 -34.26 73.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.892 -0.595 . . . . 73.2 110.654 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.414 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -81.02 -22.12 39.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 74.31 111.138 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -83.59 -22.84 32.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.295 -0.412 . . . . 72.41 111.079 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 41.9 m-20 -84.46 -54.24 4.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 71.42 111.49 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.414 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 3.1 p-80 -62.08 -32.9 73.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.073 -0.512 . . . . 64.11 111.288 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.471 ' CD1' ' CZ ' ' A' ' 37' ' ' PHE . 8.3 tt -47.69 -40.52 20.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.887 0.375 . . . . 74.43 111.201 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -78.14 -38.06 44.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.061 -0.518 . . . . 74.31 110.598 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.77 -38.45 86.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.992 -0.549 . . . . 61.15 110.823 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.1 p -87.85 -7.08 57.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 75.51 111.526 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 47.65 41.13 13.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.707 0.289 . . . . 74.44 111.556 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -107.34 46.04 0.96 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.91 0.386 . . . . 73.24 110.845 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.463 ' CD2' HD23 ' A' ' 66' ' ' LEU . 88.3 m-85 -60.58 179.07 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.014 -0.539 . . . . 74.4 110.741 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 41.2 tttm -65.54 135.98 55.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 74.41 110.798 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -113.28 179.99 19.16 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.746 -0.74 . . . . 73.32 112.497 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 69.4 m -61.58 139.15 58.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.834 0.349 . . . . 74.54 110.871 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -145.18 -46.91 0.23 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 74.43 110.943 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.419 ' O ' ' CG1' ' A' ' 78' ' ' ILE . 3.6 m -128.89 -45.2 1.29 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.025 -0.534 . . . . 72.12 110.963 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.419 ' CG1' ' O ' ' A' ' 77' ' ' SER . 38.1 pt 45.1 -171.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.893 -0.594 . . . . 74.32 111.699 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 50.1 m -82.44 131.33 35.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.352 -0.386 . . . . 73.21 110.87 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.9 mtpm? -155.75 115.9 3.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 73.34 110.939 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 31.6 m -107.07 -32.3 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 64.04 111.1 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.7 p -173.86 176.51 2.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.438 . . . . 73.14 110.905 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -144.24 118.26 9.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.459 . . . . 73.32 110.871 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -128.28 146.94 50.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 73.32 110.943 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -134.73 104.49 5.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.259 -0.428 . . . . 73.44 111.095 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.02 144.67 56.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 74.35 110.847 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -92.87 111.42 23.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 72.42 110.915 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.5 t 63.85 90.99 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 65.21 111.133 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -173.66 -41.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.434 . . . . 75.14 110.915 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.6 tp 56.84 100.4 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.015 -0.539 . . . . 64.54 111.023 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -156.59 121.68 4.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.235 -0.438 . . . . 75.41 110.935 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 62.65 145.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 73.3 111.029 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -112.77 -34.74 5.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.185 -0.461 . . . . 74.42 110.926 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 16.4 mttm -101.67 158.9 30.9 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 73.24 110.894 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.71 -40.52 73.59 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.583 2.189 . . . . 74.45 112.279 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 56.81 -168.22 0.11 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.023 -0.535 . . . . 74.13 111.005 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 61.03 169.07 0.1 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 71.24 110.919 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.7 m -163.63 34.05 0.09 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 74.14 110.868 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 64.51 -79.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 75.04 110.9 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 26.5 m -60.13 146.41 43.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.132 -0.485 . . . . 74.53 110.864 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -144.08 78.63 1.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 73.02 110.892 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -176.65 92.7 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 72.42 110.873 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 8.8 p -106.24 -33.13 7.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 61.43 110.885 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -166.24 173.96 9.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 74.22 110.915 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -110.05 -31.02 7.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 71.43 110.971 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -89.64 -31.9 17.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 73.01 110.927 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 111.07 109.55 3.14 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.736 -0.745 . . . . 52.41 112.394 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.61 162.03 40.98 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.46 2.106 . . . . 51.45 112.306 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.425 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 39.8 Cg_exo -57.15 -160.64 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.647 2.232 . . . . 75.04 112.353 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -97.2 37.7 1.31 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.213 -0.449 . . . . 75.44 111.0 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.425 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 21.0 p90 -165.68 166.86 17.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 75.35 110.906 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.449 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 0.3 OUTLIER -134.03 127.66 32.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.479 . . . . 71.42 110.546 179.807 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.01 144.51 49.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.951 0.405 . . . . 74.33 111.231 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.3 m -143.16 115.34 8.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.004 -0.544 . . . . 73.32 110.71 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 24.2 t -74.61 106.27 4.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.292 -0.413 . . . . 74.33 111.331 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.0 mp -74.04 -63.06 1.3 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 72.45 110.758 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.6 108.07 16.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 75.13 110.878 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.78 140.79 54.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.222 -0.445 . . . . 75.35 110.98 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.505 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -112.37 -154.38 12.17 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.795 -0.717 . . . . 74.33 112.404 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -36.8 -51.9 0.9 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.956 0.408 . . . . 73.3 111.446 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.7 tttm 69.69 35.64 2.34 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.908 -0.587 . . . . 73.12 110.197 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.27 -44.76 0.09 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.702 -0.681 . . . . 73.22 110.724 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -89.08 89.44 7.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 72.31 110.843 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -97.61 154.72 37.83 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.479 . . . . 75.04 110.909 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.41 125.59 11.97 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.577 2.185 . . . . 65.33 112.356 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -99.75 153.22 19.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 75.01 110.914 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.55 116.9 5.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.245 -0.434 . . . . 75.55 110.856 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 107.42 -23.21 27.21 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.715 -0.755 . . . . 71.42 112.517 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.38 139.73 30.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.771 0.319 . . . . 74.25 110.732 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.512 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 16.9 m -70.84 174.32 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.035 0.445 . . . . 75.52 111.432 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.655 ' O ' ' HA ' ' A' ' 163' ' ' SER . 20.7 m -157.51 145.49 10.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.66 -0.7 . . . . 64.04 110.387 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.465 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.22 117.72 22.88 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.722 0.296 . . . . 75.42 110.683 179.815 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.451 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 27.3 p -155.2 170.86 20.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.027 0.441 . . . . 72.31 111.191 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.425 ' CZ2' ' HG3' ' A' ' 161' ' ' PRO . 8.8 m95 -106.37 163.64 12.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.84 -0.618 . . . . 75.11 110.21 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.448 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 35.8 p90 -160.97 135.18 7.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.129 0.49 . . . . 71.41 111.751 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.41 110.7 14.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.612 -0.722 . . . . 74.53 110.137 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.581 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.61 144.27 17.07 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.565 -0.826 . . . . 73.11 113.468 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.72 130.26 12.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.681 0.277 . . . . 74.12 110.385 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 35.3 mt -60.93 -178.32 0.1 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.445 -0.343 . . . . 73.32 110.841 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -56.04 -41.48 75.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 74.23 110.746 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -83.56 -0.57 50.94 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.979 -0.555 . . . . 75.03 111.474 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 93.79 25.79 16.75 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.64 -0.791 . . . . 62.31 112.637 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.12 111.48 17.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.76 0.314 . . . . 72.21 110.874 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 34.9 t -65.59 120.91 13.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 75.4 111.17 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.427 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 35.2 p90 -112.13 -24.71 9.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 75.45 111.06 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . 0.414 ' HB2' ' CE1' ' A' ' 145' ' ' PHE . 28.9 m-20 -161.89 113.37 1.69 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.427 -0.351 . . . . 74.51 110.94 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 90.0 m -125.29 105.58 9.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 73.42 111.04 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . 0.448 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 19.7 t30 -88.73 -0.62 57.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 73.31 111.27 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.408 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 21.7 mm -70.7 85.3 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.757 0.313 . . . . 74.12 110.913 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -74.99 167.93 20.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.283 -0.417 . . . . 72.43 110.893 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 17.3 p -59.38 166.02 2.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 71.23 110.959 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 12.0 p -75.13 150.19 38.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 75.43 110.901 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.06 -27.28 35.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.469 . . . . 72.14 111.249 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.97 -31.12 64.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.275 -0.421 . . . . 70.24 110.983 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.17 -29.48 17.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 74.32 110.963 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -173.13 125.48 0.43 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 73.5 110.897 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 13.7 mmtt -59.86 94.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 71.12 110.887 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -165.65 42.72 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 73.24 110.885 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -141.65 121.94 13.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 75.43 111.094 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -146.38 112.53 4.37 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 73.11 110.844 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . 0.425 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 67.1 Cg_exo -51.01 154.02 7.97 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.422 2.081 . . . . 72.42 112.328 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.412 ' CD2' ' CD1' ' A' ' 164' ' ' PHE . 3.2 tt -78.35 122.37 25.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 65.01 110.522 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.655 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -100.42 121.35 41.4 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.94 0.4 . . . . 74.54 111.236 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . 0.426 ' CE1' ' CG2' ' A' ' 131' ' ' VAL . 10.1 p90 -150.1 141.74 23.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.98 -0.555 . . . . 74.31 110.731 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 72.6 mttt -77.33 136.63 38.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.083 0.468 . . . . 75.23 111.201 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.0 m -87.64 149.38 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.704 -0.68 . . . . 73.54 111.185 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.83 24.09 75.65 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.912 -0.661 . . . . 73.21 112.673 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 14.4 m -132.27 44.77 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.914 0.388 . . . . 72.1 111.043 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.7 36.39 4.67 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 121.188 -0.529 . . . . 72.52 113.215 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 3.0 mmtm -82.99 -47.11 12.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.941 0.401 . . . . 61.21 110.983 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . 0.419 HG12 ' CE3' ' A' ' 175' ' ' TRP . 0.6 OUTLIER -118.3 -179.65 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.963 -0.562 . . . . 75.2 110.992 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.508 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -58.82 159.54 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 75.33 111.23 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -68.25 -26.1 65.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 71.44 111.297 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -77.84 -37.06 30.75 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.669 -0.777 . . . . 74.24 112.198 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.508 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.4 t90 -77.3 -33.57 55.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.897 0.38 . . . . 73.33 111.17 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.96 -37.16 83.76 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.016 -0.538 . . . . 74.14 110.617 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -73.27 -30.07 63.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.016 -0.538 . . . . 71.3 110.731 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -83.4 -48.82 9.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.147 -0.479 . . . . 74.21 111.249 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.462 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 9.4 mt -63.47 -34.42 77.72 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.074 -0.512 . . . . 62.31 110.801 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 35.6 tp -55.71 -23.12 27.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 75.24 111.115 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 51.1 p -98.64 2.25 47.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.368 -0.378 . . . . 72.03 111.567 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.19 152.39 34.82 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.729 0.299 . . . . 71.51 110.737 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -115.43 161.99 17.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.31 -0.405 . . . . 64.2 111.259 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -60.05 122.51 14.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.94 -0.573 . . . . 75.11 110.461 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 66.72 60.41 6.19 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.556 -0.83 . . . . 54.52 112.373 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . 0.505 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 17.1 tt0 -141.58 148.28 39.03 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.306 -0.257 . . . . 74.34 110.306 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 9.9 ttpt -117.26 135.61 53.69 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.184 -0.302 . . . . 74.31 110.184 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.73 168.9 18.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.126 0.489 . . . . 75.44 111.809 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.72 101.11 4.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.597 -0.729 . . . . 75.44 109.711 179.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.449 ' HA ' ' O ' ' A' ' 112' ' ' THR . 0.3 OUTLIER -115.34 143.91 44.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.101 0.477 . . . . 74.23 112.06 -178.853 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -118.0 115.07 24.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.603 -0.726 . . . . 75.22 110.531 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.422 HD11 ' CZ ' ' A' ' 216' ' ' PHE . 3.3 mp -96.93 134.79 33.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 74.04 111.247 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -70.89 166.1 40.66 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.912 -0.586 . . . . 73.33 110.808 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.94 -14.42 44.44 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.579 2.186 . . . . 72.14 112.604 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -79.64 -25.71 41.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.68 0.276 . . . . 70.34 111.245 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . . . . . . . . . 12.8 m0 -117.1 37.08 3.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.452 -0.34 . . . . 75.22 111.277 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -145.97 -83.46 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.353 -0.385 . . . . 70.24 111.356 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.446 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 15.8 m-85 -109.43 -34.5 6.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.901 0.381 . . . . 75.34 110.875 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 118.18 170.02 14.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.85 -0.69 . . . . 72.1 112.577 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.89 -29.0 62.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.806 0.336 . . . . 65.11 110.926 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -66.67 -50.69 62.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.224 -0.444 . . . . 73.25 110.856 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 115.31 -162.66 12.4 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.87 -0.681 . . . . 54.11 112.468 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . 0.424 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 1.2 tm0? -137.0 77.65 42.78 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.891 0.377 . . . . 75.42 110.863 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.61 -23.23 24.91 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.625 2.216 . . . . 73.43 112.422 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.96 -41.89 79.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.298 -0.41 . . . . 74.01 111.046 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.96 30.4 6.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.088 -0.506 . . . . 73.12 111.126 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.32 35.67 25.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 73.02 110.918 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . 0.438 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 32.0 mt -98.53 111.74 60.78 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.454 . . . . 75.34 111.095 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.13 171.11 15.48 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.478 2.119 . . . . 72.11 112.373 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.56 142.12 69.93 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.586 2.19 . . . . 73.21 112.265 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 54.18 69.44 0.72 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.208 -0.451 . . . . 64.22 111.024 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -122.43 115.02 21.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 63.32 111.466 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -65.35 131.49 46.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.043 -0.526 . . . . 75.53 110.452 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.446 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 4.9 mt -113.58 109.41 18.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.896 0.379 . . . . 64.34 111.68 -179.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 2.8 m -109.59 140.1 43.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.546 . . . . 73.13 110.417 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.581 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 4.7 p90 -156.32 -179.29 8.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.013 0.435 . . . . 74.14 111.387 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -134.34 137.65 44.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.721 -0.672 . . . . 74.44 110.432 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.7 t -120.32 151.76 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.99 0.424 . . . . 75.44 111.997 -179.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -136.33 105.87 6.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.777 -0.647 . . . . 72.1 110.221 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . 0.451 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 1.0 OUTLIER -69.96 129.5 39.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.343 -0.39 . . . . 75.21 110.845 -179.755 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 33.7 t -108.24 -28.99 2.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.266 -0.424 . . . . 72.45 111.426 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . 0.402 ' O ' HD22 ' A' ' 220' ' ' LEU . 5.5 t70 -171.18 162.23 6.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.839 0.352 . . . . 60.14 111.024 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 46.5 mt -140.75 111.16 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 74.13 111.135 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 72.1 110.817 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 mtm . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.79 0.329 . . . . 70.5 111.208 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -132.44 173.21 11.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 74.22 111.095 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -158.96 97.65 1.42 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 74.21 111.057 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 59.33 96.75 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 72.24 111.131 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.1 t -60.18 110.67 3.04 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 74.24 110.952 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.428 ' HD2' ' CE1' ' A' ' 72' ' ' PHE . 85.6 Cg_endo -80.46 145.46 16.67 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.632 2.221 . . . . 74.22 112.426 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -81.28 149.72 28.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.267 -0.424 . . . . 74.23 110.884 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.63 98.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 70.42 111.33 -179.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.58 -19.19 64.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.983 -0.553 . . . . 65.32 111.391 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.441 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 2.9 m-90 -136.99 173.89 11.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.96 0.409 . . . . 74.31 110.914 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -115.64 150.89 35.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.871 -0.604 . . . . 72.4 110.475 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 32.7 t -56.11 -32.01 32.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.929 0.395 . . . . 73.11 110.818 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -73.98 -26.29 60.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.959 -0.564 . . . . 73.44 111.21 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -82.26 -57.27 3.45 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.892 0.377 . . . . 73.0 111.095 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.5 mt -49.67 -63.46 1.1 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.153 -0.476 . . . . 64.55 111.158 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.7 mtt180 -54.34 -24.42 19.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.125 -0.489 . . . . 74.02 111.217 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.08 176.97 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.944 0.402 . . . . 75.02 111.115 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -110.35 16.69 21.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.941 -0.572 . . . . 73.01 111.13 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -108.34 -28.02 9.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.519 -0.31 . . . . 74.54 111.093 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.441 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 7.0 tt -85.9 113.11 49.8 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.334 -0.393 . . . . 71.24 110.967 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -56.39 123.96 15.11 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.401 2.067 . . . . 75.55 112.172 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -24.11 65.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 74.44 111.089 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.7 mmtp -53.7 -33.59 55.96 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.281 -0.418 . . . . 70.04 111.332 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -78.76 -51.87 9.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.966 0.413 . . . . 71.41 110.998 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.468 HG22 HD12 ' A' ' 25' ' ' ILE . 31.1 mt -46.82 -33.17 2.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.896 -0.593 . . . . 75.04 111.311 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 12.1 mt -74.95 -52.94 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.084 0.468 . . . . 75.15 111.015 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.01 -22.8 41.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.752 -0.658 . . . . 75.04 111.323 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -75.08 -49.37 19.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.966 0.413 . . . . 72.41 110.851 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 mt -65.5 -26.63 68.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.914 -0.585 . . . . 75.22 110.938 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -81.27 -27.03 35.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.295 -0.411 . . . . 70.24 111.038 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.426 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -97.09 -6.13 35.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.492 -0.322 . . . . 75.25 111.198 179.714 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.426 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 92.2 m-70 -128.4 -3.23 5.52 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.346 . . . . 73.13 111.484 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.65 157.21 15.58 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.711 -0.757 . . . . 74.41 112.289 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.4 p -92.66 149.89 21.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.624 0.25 . . . . 65.44 110.625 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -44.15 -49.77 8.9 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.405 -0.361 . . . . 74.12 111.49 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.6 p -55.03 -47.42 74.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.008 0.433 . . . . 65.33 110.506 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.492 ' CE2' ' CE1' ' A' ' 65' ' ' HIS . 4.1 t80 -58.13 -44.12 87.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.692 . . . . 72.41 110.703 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.442 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 3.1 mt -63.57 -49.19 74.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.256 -0.429 . . . . 71.31 110.895 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -49.2 -28.19 4.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.115 -0.493 . . . . 71.25 111.349 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -77.43 -33.1 54.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 71.43 111.218 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.431 ' NE2' ' CE1' ' A' ' 65' ' ' HIS . 6.3 m-70 -108.78 10.42 26.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.395 -0.366 . . . . 74.34 111.58 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' A' ' 38' ' ' LEU . 12.8 mttp 60.21 31.86 20.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.779 0.323 . . . . 74.1 110.992 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.415 ' CB ' ' CD2' ' A' ' 38' ' ' LEU . 64.5 mt -84.56 -21.12 30.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 73.31 111.054 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.442 ' N ' ' HB3' ' A' ' 38' ' ' LEU . 61.7 mt -48.75 170.34 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.944 0.402 . . . . 73.04 111.104 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.27 -163.39 34.26 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.784 -0.722 . . . . 62.41 112.78 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -102.85 148.77 25.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.88 0.372 . . . . 74.12 111.016 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.1 mp -45.27 -43.29 3.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.015 -0.539 . . . . 72.33 111.498 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -56.44 -42.33 77.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.877 -0.601 . . . . 73.33 111.092 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -85.74 -28.17 24.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.084 -0.507 . . . . 74.53 111.336 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.2 t -77.41 -26.42 15.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 75.21 111.478 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.55 -25.24 65.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.383 -0.371 . . . . 61.22 111.311 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.3 pttt -95.22 -30.95 13.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.311 -0.404 . . . . 74.35 111.136 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 m -84.98 -22.21 29.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 74.13 111.381 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -113.0 128.7 56.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.828 0.347 . . . . 72.32 111.283 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -78.9 179.89 7.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 74.34 110.447 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.82 -58.48 8.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.84 0.353 . . . . 73.44 110.537 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.49 -26.38 67.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.109 -0.496 . . . . 75.54 110.6 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.67 -40.4 94.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.114 0.483 . . . . 71.11 110.261 179.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 17.4 mt -77.42 -30.04 53.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.659 -0.701 . . . . 74.51 111.036 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 17.8 t -79.11 -43.33 24.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.942 0.401 . . . . 70.05 110.752 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 75.4 m -60.05 -34.49 73.49 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.895 -0.593 . . . . 73.44 110.486 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.418 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -82.01 -21.72 36.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.006 -0.543 . . . . 71.53 110.898 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.409 ' CD1' ' O ' ' A' ' 63' ' ' TYR . 16.3 t80 -83.79 -22.78 31.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 72.31 110.97 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -85.07 -54.33 4.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.136 -0.483 . . . . 65.34 111.479 -179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.492 ' CE1' ' CE2' ' A' ' 37' ' ' PHE . 2.9 p-80 -62.08 -25.34 67.64 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.16 -0.473 . . . . 74.34 111.385 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.439 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 3.4 tt -53.65 -39.89 65.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.967 0.413 . . . . 74.04 110.945 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.401 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.2 m-85 -79.06 -39.88 32.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.93 -0.577 . . . . 72.22 110.641 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.1 -40.31 90.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.985 -0.552 . . . . 72.41 110.957 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 57.9 p -88.06 -9.77 52.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.033 -0.53 . . . . 74.45 111.413 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.21 33.63 12.87 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.763 0.316 . . . . 72.14 111.192 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 66.6 mtt-85 -92.52 46.18 1.23 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.356 -0.384 . . . . 73.21 111.019 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.439 ' CD1' HD21 ' A' ' 66' ' ' LEU . 91.9 m-85 -67.17 175.8 2.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 65.43 110.856 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 49.4 tttt -73.07 152.98 41.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.352 -0.385 . . . . 74.12 110.882 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -157.4 127.57 1.95 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.738 -0.744 . . . . 72.25 112.569 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.2 p 57.92 107.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.829 0.347 . . . . 62.24 110.95 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -176.01 -39.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 71.34 110.94 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 19.6 p -139.39 117.53 11.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.09 -0.505 . . . . 75.54 110.9 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 9.2 pt -159.02 -42.55 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.175 -0.466 . . . . 73.25 111.24 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 70.4 m 60.57 111.06 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.153 -0.476 . . . . 62.35 110.881 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 29.7 mttt -134.48 126.01 28.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 74.23 110.891 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.3 p -92.24 52.36 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 74.34 111.046 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 65.7 m -152.97 149.31 28.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.11 -0.495 . . . . 72.13 110.902 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -100.97 -42.58 6.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 73.12 110.847 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 59.32 99.04 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.002 -0.545 . . . . 74.12 110.953 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t 59.28 88.41 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.47 . . . . 74.42 111.174 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.5 mmtt -151.02 -176.63 5.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.449 . . . . 75.12 110.962 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -89.67 141.13 28.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 75.12 110.854 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 12.5 p -68.64 137.65 23.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 74.11 111.102 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.4 tttp -175.74 -40.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 75.51 110.946 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -128.03 136.67 51.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.092 -0.504 . . . . 75.13 110.93 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -128.25 132.66 48.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 71.41 110.876 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -83.83 158.03 21.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 73.45 110.935 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.34 -34.1 7.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 65.51 110.91 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -173.18 150.66 1.94 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 74.31 110.898 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.52 -172.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.54 2.16 . . . . 74.12 112.287 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -177.29 -39.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 75.11 110.936 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -103.1 133.96 47.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 74.32 110.935 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.8 t -130.1 141.48 50.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 74.04 110.926 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -108.03 -179.18 3.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 71.34 110.891 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 57.4 m 62.76 -80.56 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.152 -0.476 . . . . 74.34 111.015 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 60.29 35.7 20.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.239 -0.437 . . . . 75.1 110.961 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -102.87 111.48 23.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.173 -0.467 . . . . 62.05 110.88 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 73.3 p -78.96 145.15 34.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 74.33 110.908 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.1 mp -138.98 -178.12 5.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 55.11 110.925 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -81.6 -177.62 6.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 73.41 110.894 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -89.85 97.73 11.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.449 . . . . 74.01 110.919 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 91.48 52.48 2.32 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.728 -0.749 . . . . 62.45 112.552 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.16 171.46 14.85 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.601 2.201 . . . . 74.4 112.307 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.34 -176.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.574 2.183 . . . . 75.13 112.252 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.423 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.1 OUTLIER -103.07 28.69 6.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 74.32 110.959 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 30.8 p90 -149.46 162.23 40.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 75.02 110.819 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 5.8 m -132.0 103.55 6.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 75.43 111.058 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -111.09 145.16 39.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.207 -0.451 . . . . 74.0 110.797 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.408 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.5 m -137.97 130.77 29.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 75.11 110.941 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 22.1 t -80.47 106.32 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 63.45 111.14 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.408 HD12 ' O ' ' A' ' 114' ' ' SER . 7.4 mp -76.28 -50.01 15.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.224 -0.444 . . . . 75.02 110.768 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.85 111.55 16.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.089 -0.505 . . . . 74.21 110.902 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.95 142.35 46.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 75.11 110.904 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.478 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -114.57 -155.78 11.27 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.741 -0.742 . . . . 72.3 112.615 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -37.21 -52.43 1.05 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.013 0.435 . . . . 72.5 111.415 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 71.22 35.84 1.49 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.789 -0.642 . . . . 73.2 110.178 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 57.2 m -152.98 -43.81 0.1 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.712 -0.676 . . . . 73.23 110.692 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -92.73 95.85 9.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 74.42 110.838 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -107.41 146.12 32.64 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.138 -0.483 . . . . 74.4 110.756 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -56.35 125.34 18.75 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.429 2.086 . . . . 74.02 112.454 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.02 150.37 22.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.981 -0.554 . . . . 63.32 110.909 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -53.93 114.18 1.49 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.42 . . . . 72.34 110.856 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.14 -23.62 33.87 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.58 -0.819 . . . . 71.33 112.356 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -81.58 135.59 35.56 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.817 0.341 . . . . 73.4 110.628 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.544 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 12.8 m -73.62 175.78 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.284 0.564 . . . . 72.44 111.795 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.597 ' O ' ' HA ' ' A' ' 163' ' ' SER . 20.5 m -157.29 146.37 10.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.247 -0.888 . . . . 71.24 110.509 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.451 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -125.43 117.29 23.35 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.983 -0.287 . . . . 72.31 110.624 179.623 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.447 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 30.9 p -153.97 167.07 30.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.951 0.405 . . . . 75.52 111.151 -179.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.432 ' CE3' HG13 ' A' ' 149' ' ' ILE . 62.2 m95 -99.67 160.73 14.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.922 -0.581 . . . . 75.44 110.074 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 34.3 p90 -158.63 134.97 9.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.102 0.477 . . . . 73.41 111.747 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.89 111.67 14.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.72 -0.673 . . . . 74.53 110.188 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.564 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.66 144.04 17.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.562 -0.828 . . . . 73.45 113.27 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -150.62 142.11 23.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.806 0.336 . . . . 63.35 110.554 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 87.7 mt -77.96 -178.21 5.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.262 -0.426 . . . . 74.5 110.93 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -58.86 -43.33 90.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.296 -0.411 . . . . 72.23 110.895 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -75.82 -4.72 42.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.96 -0.564 . . . . 63.35 111.448 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 92.61 23.07 27.05 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.679 -0.772 . . . . 74.11 112.655 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.3 m -88.28 108.31 19.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.811 0.339 . . . . 73.44 110.776 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.7 m -71.16 132.64 33.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 74.14 111.275 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -112.19 -31.19 6.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 70.33 110.895 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -143.83 123.03 12.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 73.34 110.98 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 82.9 m -137.45 105.69 5.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 70.23 110.72 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -86.17 12.6 9.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 74.55 111.702 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.447 ' CD1' ' N ' ' A' ' 149' ' ' ILE . 2.6 mp -115.78 118.91 60.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 120.83 0.348 . . . . 75.33 110.903 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -123.8 -67.68 0.92 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 74.03 110.902 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 70.1 p -126.9 166.01 18.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 71.43 110.937 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.7 m -84.03 167.82 16.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.462 . . . . 72.34 110.915 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -80.98 -30.74 35.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 73.24 111.164 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 3.8 mtmt -59.72 -33.22 71.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.439 . . . . 75.23 110.926 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.3 -34.94 71.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 75.14 110.833 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.64 -179.18 0.79 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 74.12 110.808 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 4.0 tptt -99.05 31.41 3.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.475 . . . . 73.43 110.898 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -104.72 31.39 4.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 72.22 110.95 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -152.79 119.25 5.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 63.4 111.081 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -146.56 148.22 33.12 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 75.3 110.779 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.84 156.68 65.0 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.474 2.116 . . . . 75.32 112.233 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.2 128.02 32.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.083 -0.508 . . . . 75.33 110.746 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.597 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.6 OUTLIER -105.41 126.68 52.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.27 -0.423 . . . . 62.03 111.054 179.817 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -151.0 140.94 21.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 75.31 110.977 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 10.3 mtpt -69.65 131.25 44.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.333 -0.394 . . . . 74.32 110.828 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.4 m -87.88 149.21 4.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 65.33 111.182 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 67.99 25.09 74.46 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.764 -0.732 . . . . 61.43 112.595 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 15.7 m -134.24 46.17 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.9 0.381 . . . . 75.05 111.121 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.59 35.52 3.0 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.212 -0.518 . . . . 72.43 113.276 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.15 -47.08 12.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.887 0.375 . . . . 73.31 111.056 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -118.48 -179.58 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.049 -0.523 . . . . 64.45 110.971 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.508 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.22 158.39 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.453 -0.34 . . . . 74.21 111.197 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 23.5 ttm180 -66.52 -28.57 68.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.295 -0.411 . . . . 73.3 111.301 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.48 -36.53 43.72 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.659 -0.781 . . . . 64.22 112.16 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.508 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.3 t90 -78.99 -34.37 44.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.916 0.388 . . . . 73.04 111.096 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -62.46 -38.01 88.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 73.35 110.423 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -75.45 -29.82 59.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.986 -0.552 . . . . 75.55 110.644 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -78.76 -58.32 3.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.153 -0.476 . . . . 73.2 111.128 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.48 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 5.8 mt -56.73 -34.38 67.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.983 -0.553 . . . . 71.44 110.898 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 16.4 tp -59.91 -30.34 68.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.248 -0.433 . . . . 74.12 110.694 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 32.5 p -87.11 -3.58 59.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 74.3 111.291 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 71.4 mmm -78.17 154.3 31.27 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.794 0.33 . . . . 70.23 110.718 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 10.4 p -121.19 170.33 9.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 54.42 111.175 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.94 117.43 5.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.011 -0.541 . . . . 74.34 110.776 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . 0.407 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 70.48 66.82 2.08 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.701 -0.762 . . . . 55.02 112.224 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . 0.478 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 19.0 tt0 -146.02 147.25 31.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.636 0.255 . . . . 74.44 110.563 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -121.98 136.54 54.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.761 0.315 . . . . 72.12 110.262 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -150.0 176.16 11.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.076 0.465 . . . . 74.43 111.495 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.76 135.17 36.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.795 -0.639 . . . . 73.42 109.594 178.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.41 ' HG ' ' CE1' ' A' ' 216' ' ' PHE . 1.2 pt? -140.12 140.02 35.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.2 0.524 . . . . 75.42 112.361 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -116.3 112.05 20.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.54 -0.754 . . . . 64.23 109.912 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.45 ' CD1' ' CE2' ' A' ' 216' ' ' PHE . 2.1 mp -97.47 143.08 13.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.001 0.429 . . . . 71.14 111.543 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -76.89 154.88 83.11 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.861 -0.609 . . . . 75.34 110.676 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . 0.438 ' CG ' ' HA ' ' A' ' 211' ' ' ASN . 73.4 Cg_exo -50.89 -39.84 58.36 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.629 2.219 . . . . 74.31 112.419 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.31 -40.63 82.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 73.42 111.235 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . 0.423 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 5.7 m0 -96.64 36.84 1.33 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.396 -0.365 . . . . 73.51 111.147 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -162.83 -76.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 75.52 110.888 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.438 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 25.7 m-85 -106.27 -71.21 0.76 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 73.32 110.672 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 143.05 -179.9 20.25 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.799 -0.715 . . . . 74.44 112.673 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -59.34 -33.06 70.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.846 0.355 . . . . 72.33 110.903 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -51.73 48.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 65.1 110.783 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 113.51 -138.82 15.23 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.868 -0.682 . . . . 73.43 112.474 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . 0.413 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.4 OUTLIER -153.99 79.62 5.12 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.862 0.363 . . . . 62.41 110.824 179.99 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.9 -22.93 25.66 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.577 2.185 . . . . 73.11 112.41 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.8 -41.96 87.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.399 -0.364 . . . . 72.51 110.965 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -111.35 27.89 9.25 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.173 -0.467 . . . . 71.33 111.19 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 55.48 30.83 15.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.233 -0.44 . . . . 75.24 111.077 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . 0.43 HD11 ' CE2' ' A' ' 198' ' ' TYR . 31.1 mt -82.14 112.66 37.57 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.431 . . . . 74.34 111.074 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -60.04 158.99 27.44 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.474 2.116 . . . . 73.01 112.303 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -55.71 145.44 71.2 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.618 2.212 . . . . 71.51 112.284 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . 0.438 ' HA ' ' CG ' ' A' ' 194' ' ' PRO . 3.2 m-80 45.0 40.93 4.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.15 -0.477 . . . . 74.13 111.358 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -83.24 112.27 19.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 73.13 111.796 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.2 mmmm -65.02 140.63 58.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.009 -0.542 . . . . 75.3 110.276 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.438 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 5.4 mt -117.89 109.78 16.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.949 0.405 . . . . 74.22 112.026 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 1.9 m -109.16 142.88 39.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.917 -0.583 . . . . 74.43 110.061 179.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.564 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 14.8 p90 -156.57 -179.27 8.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.118 0.485 . . . . 75.33 111.617 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -131.34 135.16 47.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.612 -0.722 . . . . 74.13 110.418 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.8 t -122.82 150.46 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.457 . . . . 71.52 111.915 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.67 110.45 8.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.733 -0.667 . . . . 75.35 110.256 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . 0.447 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 2.0 tt -69.84 128.55 36.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.39 -0.368 . . . . 72.31 111.02 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 24.6 t -108.51 -29.07 2.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.158 -0.474 . . . . 64.52 111.296 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . 0.4 ' HB3' ' CD2' ' A' ' 132' ' ' HIS . 5.4 t70 -170.41 161.14 7.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.881 0.372 . . . . 72.13 111.006 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 41.7 mt -140.19 110.62 3.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.096 -0.502 . . . . 73.23 111.057 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 74.03 110.859 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mtt . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.797 0.332 . . . . 74.32 111.186 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -140.62 169.7 17.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 71.02 111.078 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -157.56 107.25 2.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 43.01 111.092 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 59.26 163.63 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 74.24 111.084 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 50.3 t -123.9 123.27 26.21 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.233 -0.439 . . . . 63.45 111.157 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -81.59 138.84 10.97 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.738 2.292 . . . . 75.0 112.325 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -81.14 148.84 29.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 75.51 111.052 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.92 120.59 5.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 74.25 111.102 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -94.95 -10.96 29.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.065 -0.516 . . . . 72.34 111.403 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.445 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 3.8 m-90 -138.19 173.67 11.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.912 0.386 . . . . 74.1 110.863 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.3 m -118.22 152.06 36.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.009 -0.541 . . . . 75.02 110.661 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 34.2 t -57.71 -33.34 44.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.369 -0.378 . . . . 74.41 110.685 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -77.37 -24.94 50.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.964 -0.562 . . . . 62.52 111.037 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.03 -57.65 3.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.832 0.348 . . . . 74.34 110.843 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mt -51.1 -60.71 2.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.221 -0.445 . . . . 72.24 111.001 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -54.16 -24.14 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 75.24 111.114 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.12 177.86 0.31 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.307 -0.406 . . . . 70.15 111.045 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -110.31 16.72 21.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.935 -0.575 . . . . 72.21 111.167 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -104.39 -27.86 11.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.514 -0.312 . . . . 73.24 111.156 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.445 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 6.5 tt -86.84 132.16 42.97 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.394 -0.366 . . . . 75.31 111.015 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -74.48 124.97 9.28 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.52 2.147 . . . . 74.44 112.398 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -26.33 59.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 74.42 111.188 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 mmtp -54.65 -49.06 71.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.301 -0.409 . . . . 75.5 111.293 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.05 -33.17 74.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.127 -0.488 . . . . 75.42 111.19 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.473 HG23 HD13 ' A' ' 25' ' ' ILE . 30.1 mt -66.9 -36.53 77.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 72.34 111.223 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 15.8 mt -71.85 -50.16 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.229 -0.442 . . . . 74.3 111.105 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.35 -22.9 45.53 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.847 -0.615 . . . . 73.42 111.286 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -74.46 -50.81 16.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.013 0.435 . . . . 72.44 110.809 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.4 ' O ' ' N ' ' A' ' 33' ' ' GLY . 4.5 mt -64.3 -39.17 93.37 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.87 -0.605 . . . . 73.24 110.957 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -71.18 -20.22 62.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.309 -0.405 . . . . 74.51 110.727 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 9.4 tp10 -79.58 -52.21 8.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.133 -0.485 . . . . 64.54 111.472 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.422 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 84.4 m-70 -111.18 16.48 21.0 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.876 0.325 . . . . 73.23 111.876 -179.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' A' ' 29' ' ' LEU . . . -123.05 91.08 0.44 Allowed Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.517 -0.849 . . . . 73.02 112.631 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.1 p -33.68 156.08 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.672 0.619 . . . . 73.43 112.672 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -51.45 -55.91 16.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.673 -0.694 . . . . 73.2 111.443 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.2 t -47.83 -48.05 31.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.04 0.447 . . . . 64.41 110.702 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.493 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 15.9 t80 -55.05 -49.0 72.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.678 -0.692 . . . . 75.5 110.727 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.433 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 11.6 mt -62.54 -45.54 92.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 73.12 110.937 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -49.93 -31.89 13.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.295 -0.411 . . . . 62.31 111.309 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -71.35 -33.15 69.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 74.11 111.034 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -110.03 13.32 23.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.348 -0.387 . . . . 75.02 111.502 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt 58.86 33.67 23.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.794 0.331 . . . . 72.42 111.004 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 17.8 mt -88.76 -20.1 25.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.28 -0.418 . . . . 73.03 111.107 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.433 ' N ' ' HB3' ' A' ' 38' ' ' LEU . 84.1 mt -47.77 170.32 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.894 0.378 . . . . 64.24 111.175 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.45 -154.78 24.45 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.771 -0.728 . . . . 64.41 112.778 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 40.5 m-20 -109.92 150.4 28.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.96 0.41 . . . . 72.44 111.078 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.2 mp -46.71 -39.6 4.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.972 -0.558 . . . . 75.24 111.434 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -60.21 -42.45 95.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.057 -0.52 . . . . 72.41 111.102 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -85.56 -26.62 26.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.077 -0.51 . . . . 52.43 111.216 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 17.5 t -79.58 -25.83 12.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.405 . . . . 73.53 111.448 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.42 -27.74 68.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.388 -0.369 . . . . 60.01 111.127 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.9 ptpp? -95.18 -29.21 14.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 75.33 110.986 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -96.34 33.55 1.76 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.449 . . . . 63.12 111.13 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -163.68 125.79 2.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.366 -0.379 . . . . 75.42 111.123 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.22 174.64 11.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 73.44 110.633 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.68 -58.29 8.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.892 0.377 . . . . 75.2 110.521 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.56 -24.48 67.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.005 -0.543 . . . . 74.55 110.584 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.21 -42.57 99.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.15 -0.477 . . . . 64.22 110.375 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 15.3 mt -74.85 -29.99 61.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.714 -0.675 . . . . 75.32 111.059 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 12.4 t -80.4 -43.87 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.987 0.422 . . . . 73.11 110.824 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.7 m -58.86 -34.33 71.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.93 -0.577 . . . . 73.41 110.532 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.403 ' HA ' ' ND1' ' A' ' 65' ' ' HIS . . . -83.59 -21.77 32.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.997 -0.547 . . . . 75.34 110.952 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -82.29 -22.88 35.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 70.42 111.025 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -85.82 -53.18 5.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 74.2 111.474 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.493 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.2 p-80 -62.76 -27.5 69.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.991 -0.549 . . . . 73.31 111.498 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.428 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.5 tt -50.67 -40.68 54.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.871 0.367 . . . . 73.21 111.091 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -79.05 -40.84 30.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.015 -0.539 . . . . 72.4 110.682 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.82 -38.58 91.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.978 -0.556 . . . . 73.41 111.012 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.9 p -87.35 -11.84 48.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.091 -0.504 . . . . 63.21 111.46 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt 55.07 32.26 17.9 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.737 0.303 . . . . 75.13 111.161 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 30.9 mtt-85 -91.53 47.22 1.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.32 -0.4 . . . . 74.12 111.023 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.422 ' CD1' HD21 ' A' ' 66' ' ' LEU . 96.8 m-85 -68.28 171.84 6.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 75.34 110.855 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.5 tttp -73.23 153.06 40.8 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.28 -0.418 . . . . 74.42 110.928 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -90.65 -149.09 22.18 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.755 -0.736 . . . . 73.22 112.469 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 12.8 p -100.03 92.44 5.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.792 0.33 . . . . 73.22 110.885 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -110.29 -32.98 6.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.241 -0.436 . . . . 73.32 110.907 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.3 m -173.29 125.35 0.41 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 72.13 110.887 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 4.7 mt -127.86 140.1 50.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 74.14 111.048 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.4 m 62.01 116.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 53.34 110.947 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 34.9 mmtm -149.8 147.9 28.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 73.45 110.861 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 11.3 p -144.11 131.52 17.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 75.23 111.074 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.1 t -149.79 -57.42 0.19 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 73.25 110.909 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -101.33 147.0 26.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 71.41 110.916 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -68.55 162.99 24.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.222 -0.445 . . . . 73.3 110.977 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -163.84 145.59 2.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.916 -0.584 . . . . 75.1 111.117 -179.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -159.36 -56.9 0.06 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.444 . . . . 74.42 110.883 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.0 t30 60.94 97.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 74.31 110.917 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 11.2 p -80.36 158.58 4.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 74.32 111.031 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.0 tptt -174.33 -40.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 75.42 110.929 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.2 mt -151.23 30.75 0.61 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.101 -0.499 . . . . 74.35 110.935 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 14.1 m120 59.95 109.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.215 -0.448 . . . . 55.33 110.932 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.06 147.13 48.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 74.43 110.847 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -128.5 147.5 50.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 73.03 110.908 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -158.56 87.33 2.32 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 75.42 110.899 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.09 124.1 14.03 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.6 2.2 . . . . 63.44 112.317 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 20.8 mttt 60.8 168.3 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.182 -0.463 . . . . 74.42 110.884 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.57 -172.03 0.22 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 72.3 110.926 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.6 t -102.23 155.57 18.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 75.3 110.918 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 2.0 tttp 60.35 31.64 20.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 74.3 110.916 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 16.7 m -136.59 120.32 17.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 74.42 110.896 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -100.95 99.2 9.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 65.53 110.899 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -138.08 31.17 2.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 71.43 110.899 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 5.0 t -131.38 -46.06 0.99 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 64.03 110.925 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 59.63 109.26 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.031 -0.532 . . . . 74.23 110.928 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -104.25 -53.26 2.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 54.44 110.935 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -179.87 -38.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.929 -0.578 . . . . 73.02 110.929 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 158.81 92.21 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.775 -0.726 . . . . 70.31 112.453 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.14 165.73 29.25 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.594 2.196 . . . . 75.14 112.334 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.411 ' HB3' ' CH2' ' A' ' 196' ' ' TRP . 63.3 Cg_exo -51.52 179.09 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.633 2.222 . . . . 74.55 112.307 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.439 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.4 OUTLIER -108.43 23.97 13.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 75.0 111.123 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.426 ' CZ ' ' HB2' ' A' ' 177' ' ' GLU . 4.1 p90 -132.73 -176.56 4.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 73.52 110.622 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.48 105.59 1.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.796 0.332 . . . . 75.33 111.06 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . 0.411 ' CG ' ' CD2' ' A' ' 190' ' ' LEU . 0.0 OUTLIER -101.66 139.92 36.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 75.22 110.808 179.837 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -132.34 122.72 25.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 64.12 110.905 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 9.5 p -84.0 106.38 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.472 . . . . 62.13 111.067 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -87.68 -43.33 12.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 75.42 110.788 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 11.8 ttpp -118.22 107.9 14.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 73.23 110.94 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.08 134.36 55.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.211 -0.45 . . . . 74.14 111.057 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -103.23 -106.03 3.02 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.716 -0.754 . . . . 71.32 112.329 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.79 -42.78 11.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.96 0.41 . . . . 71.03 110.703 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.09 33.9 3.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.952 -0.567 . . . . 74.35 110.836 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 61.2 m -156.32 -45.6 0.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 71.23 110.839 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 -83.22 91.88 7.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 74.25 110.972 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -103.71 141.79 23.24 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 71.03 110.821 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.69 125.55 19.44 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.493 2.128 . . . . 72.22 112.356 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -97.98 158.88 15.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.117 -0.492 . . . . 72.3 110.849 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.91 111.13 1.18 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.275 -0.42 . . . . 74.03 110.809 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 111.33 -36.66 4.09 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.755 -0.736 . . . . 75.45 112.338 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.1 130.93 42.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 64.44 110.677 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.51 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 5.9 m -73.86 179.71 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.98 0.419 . . . . 71.44 111.429 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.594 ' O ' ' HA ' ' A' ' 163' ' ' SER . 21.5 m -156.84 147.69 11.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.8 -0.636 . . . . 74.34 110.916 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.413 ' ND1' ' HB3' ' A' ' 163' ' ' SER . 0.7 OUTLIER -124.94 117.7 24.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.553 -0.294 . . . . 73.13 110.38 179.496 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.466 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.1 p -153.73 166.88 31.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.999 0.428 . . . . 73.34 111.509 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.438 ' CE3' HG12 ' A' ' 149' ' ' ILE . 54.9 m95 -100.44 163.73 12.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.796 -0.638 . . . . 73.21 110.159 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.444 ' CD1' ' HB2' ' A' ' 148' ' ' ASN . 27.9 p90 -159.2 135.19 8.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.888 0.375 . . . . 72.42 111.593 -179.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 3.4 m -122.47 106.39 10.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.088 -0.505 . . . . 64.41 110.941 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.714 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -85.98 135.79 13.67 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.938 -0.649 . . . . 72.03 113.32 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.43 143.19 27.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.802 0.334 . . . . 75.1 110.617 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 32.3 mt -81.95 -177.47 6.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 72.13 110.871 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -56.76 -42.86 80.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.469 . . . . 74.31 110.902 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.61 -9.07 58.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.949 -0.569 . . . . 72.3 111.31 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 93.33 25.86 17.63 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.64 -0.79 . . . . 72.12 112.569 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 30.4 m -87.32 108.59 19.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.808 0.337 . . . . 73.42 110.87 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.2 t -63.72 127.46 24.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 71.41 111.089 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.418 ' CE2' ' HA3' ' A' ' 137' ' ' GLY . 52.1 p90 -110.13 -31.09 7.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.272 -0.422 . . . . 74.41 110.919 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -167.88 112.19 0.66 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 74.52 110.87 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 11.9 t -125.07 126.9 46.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.211 -0.45 . . . . 63.01 110.965 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . 0.444 ' HB2' ' CD1' ' A' ' 135' ' ' TYR . 8.8 t30 -65.58 -21.81 66.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.126 -0.488 . . . . 74.33 111.159 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.438 HG12 ' CE3' ' A' ' 134' ' ' TRP . 21.4 mt -106.15 119.72 55.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.393 -0.367 . . . . 70.4 111.417 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.9 -43.96 0.43 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.221 -0.445 . . . . 74.35 111.105 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 74.6 p -98.75 153.63 18.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.376 -0.374 . . . . 64.1 110.863 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 5.8 t -115.05 166.83 11.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 74.15 110.897 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -72.8 -29.65 63.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 45.4 111.156 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.95 -61.67 2.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.218 -0.447 . . . . 71.33 110.932 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.98 -63.08 1.42 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.924 -0.58 . . . . 73.12 110.917 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.4 tptt -150.66 119.65 6.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.888 -0.596 . . . . 74.33 110.874 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -65.26 80.22 0.05 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 73.23 110.893 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 24.7 m-20 -143.26 83.03 1.77 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 62.21 110.927 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.2 122.73 4.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 72.44 111.052 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 7.4 mtpt -131.13 119.36 17.74 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 72.1 110.881 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.44 151.16 18.83 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.418 2.079 . . . . 74.52 112.26 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 2.5 tt -79.12 127.78 32.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 74.24 110.706 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.594 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 1.1 p -109.02 127.42 54.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.919 0.39 . . . . 63.14 111.346 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -153.13 145.27 23.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.965 -0.562 . . . . 75.45 110.713 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.51 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 15.8 mtmt -71.8 134.34 46.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.959 0.409 . . . . 74.31 111.028 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.0 m -87.93 149.17 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.94 -0.573 . . . . 74.34 111.345 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 62.43 29.24 72.78 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.827 -0.701 . . . . 73.51 112.607 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 35.4 m -116.76 -33.01 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.927 0.394 . . . . 64.15 111.578 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 111.99 31.29 2.72 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.69 -0.767 . . . . 64.15 111.443 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -88.59 -29.71 19.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.759 0.314 . . . . 71.32 111.067 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 14.8 m -121.75 179.63 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 75.25 111.245 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.477 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 2.7 pt -59.58 169.45 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.108 -0.496 . . . . 63.22 111.082 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -76.05 -28.41 57.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.315 -0.402 . . . . 74.41 111.099 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -73.15 -30.57 62.76 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.72 -0.752 . . . . 74.55 112.015 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.508 ' CD1' ' CD1' ' A' ' 190' ' ' LEU . 0.6 OUTLIER -84.05 -34.46 24.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.88 0.372 . . . . 74.12 110.838 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -58.31 -40.76 82.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.036 -0.529 . . . . 73.11 110.488 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . 0.426 ' HB2' ' CZ ' ' A' ' 111' ' ' TYR . 4.8 mt-10 -80.14 -29.4 38.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.847 -0.615 . . . . 74.41 110.631 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -76.07 -60.77 2.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.205 -0.452 . . . . 72.32 111.23 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.441 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 0.3 OUTLIER -56.3 -35.04 67.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.975 -0.557 . . . . 74.41 110.992 -179.95 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.5 tp -64.76 -28.4 69.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 70.01 111.06 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 22.4 m -89.5 -8.81 52.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.3 -0.409 . . . . 74.43 111.444 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -77.6 156.29 30.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.819 0.342 . . . . 75.31 110.963 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.81 168.96 9.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 73.23 110.875 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -68.36 125.31 26.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.272 -0.422 . . . . 73.3 110.99 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 70.28 35.34 69.71 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.834 -0.698 . . . . 75.21 112.597 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -120.37 147.24 45.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.831 0.348 . . . . 75.22 110.922 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt -114.82 140.49 48.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 74.4 110.117 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -147.58 175.86 10.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.028 0.442 . . . . 75.04 111.705 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.23 120.05 26.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.777 -0.647 . . . . 74.33 109.981 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.508 ' CD1' ' CD1' ' A' ' 175' ' ' TRP . 3.5 mt -99.4 161.66 13.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.429 0.633 . . . . 71.42 112.271 -179.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -149.13 105.11 3.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.843 -1.071 . . . . 65.14 109.696 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.45 ' CD1' ' CZ ' ' A' ' 216' ' ' PHE . 3.0 mt -111.7 138.12 41.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.065 0.459 . . . . 75.45 111.798 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.414 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.3 mt-10 -75.84 167.83 33.22 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.647 -0.706 . . . . 62.0 110.445 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . 0.414 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 36.3 Cg_endo -64.8 -15.56 50.91 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.46 2.107 . . . . 74.33 112.633 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.14 -24.78 30.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.567 -0.288 . . . . 72.34 111.701 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . 0.439 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 3.0 m0 -110.37 37.18 2.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.74 0.305 . . . . 74.41 111.558 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -149.78 -83.07 0.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.428 -0.351 . . . . 72.34 111.43 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.456 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 25.5 m-85 -107.72 -31.65 7.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.98 0.419 . . . . 74.15 110.921 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 119.61 169.18 14.13 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.875 -0.679 . . . . 61.4 112.629 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.01 -29.75 44.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.885 0.374 . . . . 73.22 110.834 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -67.34 -46.88 72.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.081 -0.509 . . . . 73.52 110.68 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.56 -141.81 16.74 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.819 -0.705 . . . . 74.33 112.396 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . 0.429 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.0 OUTLIER -155.77 79.41 4.25 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 120.846 0.355 . . . . 71.54 110.773 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.16 -22.68 26.53 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.65 2.233 . . . . 74.13 112.567 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.01 -42.05 84.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.898 0.38 . . . . 65.11 110.992 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.73 31.2 6.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.116 -0.493 . . . . 70.13 111.11 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 18.1 mtpt 56.86 32.95 22.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.246 -0.434 . . . . 75.55 110.935 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . 0.448 HD12 ' CE2' ' A' ' 198' ' ' TYR . 50.4 mt -93.26 111.8 53.55 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.143 -0.481 . . . . 75.12 111.046 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -69.16 170.67 15.32 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.426 2.084 . . . . 61.02 112.384 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.23 151.47 49.04 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.63 2.22 . . . . 74.04 112.461 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 57.15 24.86 10.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 71.11 111.329 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -83.75 147.22 27.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.894 0.378 . . . . 74.43 111.467 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -93.92 156.09 16.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 72.14 110.303 179.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.456 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 14.1 mt -136.4 109.51 7.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.953 0.406 . . . . 65.11 111.857 -179.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 94.9 m -111.27 141.19 45.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.933 -0.576 . . . . 74.53 110.251 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.714 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 21.4 p90 -161.78 120.12 2.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.951 0.405 . . . . 74.52 111.73 -179.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.68 139.45 47.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.022 -0.535 . . . . 75.32 110.813 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.6 t -123.02 151.32 27.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.997 -0.547 . . . . 73.41 111.102 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -136.8 111.32 8.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.281 -0.418 . . . . 64.24 110.639 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . 0.466 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 0.4 OUTLIER -69.56 129.54 39.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.842 0.353 . . . . 73.52 110.835 -179.722 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 40.1 t -107.37 -30.54 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.475 . . . . 74.44 111.07 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -167.74 157.8 10.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.211 -0.45 . . . . 65.32 110.895 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 3.9 mp -141.14 111.31 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 74.41 111.091 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 34.5 t70 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 74.45 110.935 -179.961 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.4 mtt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.784 0.326 . . . . 73.54 111.191 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.22 142.42 28.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 72.24 111.102 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.88 152.19 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.447 . . . . 73.52 111.009 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 168.33 76.52 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.153 -0.476 . . . . 75.23 111.144 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 42.4 t -83.68 112.48 40.22 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.507 -0.315 . . . . 72.22 110.798 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.454 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.3 Cg_endo -78.48 134.67 12.64 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.654 2.236 . . . . 74.21 112.525 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -80.19 156.54 26.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.178 -0.464 . . . . 74.3 110.807 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.25 93.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 71.45 111.379 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.44 86.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 73.33 110.992 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.414 ' CD1' HD11 ' A' ' 20' ' ' LEU . 1.5 m-90 -115.46 173.64 6.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.966 -0.561 . . . . 73.53 110.689 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.2 154.77 31.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.101 -0.5 . . . . 74.54 110.618 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 95.9 t -57.11 -35.87 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.973 0.416 . . . . 64.31 110.501 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -67.96 -30.34 69.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.87 -0.605 . . . . 73.44 111.143 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -82.04 -56.09 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.37 -0.377 . . . . 74.32 111.238 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.5 mt -49.55 -65.6 0.54 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.285 -0.416 . . . . 75.3 111.327 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.71 -25.49 18.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 65.21 111.259 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.42 173.68 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.99 0.424 . . . . 75.52 111.36 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.38 17.04 21.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.888 -0.596 . . . . 72.41 111.176 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -112.23 -19.98 12.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.655 0.264 . . . . 73.42 111.307 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.414 HD11 ' CD1' ' A' ' 10' ' ' TRP . 2.1 tt -90.59 112.18 51.68 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.609 -0.269 . . . . 75.33 111.008 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -57.69 128.42 29.1 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.411 2.074 . . . . 72.42 112.227 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.4 -24.15 67.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.462 . . . . 74.24 111.204 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -51.76 -40.13 59.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.394 -0.366 . . . . 75.55 111.581 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.89 -57.42 4.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.957 0.408 . . . . 74.34 111.164 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 4.7 mt -44.81 -32.78 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.891 -0.595 . . . . 75.44 111.556 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.4 mt -75.1 -40.7 44.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.937 0.399 . . . . 75.42 110.991 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -71.02 -24.03 62.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.977 -0.556 . . . . 72.02 111.029 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 24.1 t80 -71.47 -45.05 63.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.041 0.448 . . . . 62.32 110.86 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.1 mt -69.57 -24.01 63.64 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.783 -0.644 . . . . 74.52 111.11 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -79.3 -25.05 42.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.348 -0.387 . . . . 74.4 111.005 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.1 -10.58 18.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.384 -0.371 . . . . 72.33 111.24 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 11.9 m170 -117.62 -9.7 10.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.54 -0.3 . . . . 75.52 111.438 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.49 164.4 15.53 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.688 -0.768 . . . . 64.21 112.379 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.98 150.4 21.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.683 0.277 . . . . 61.51 110.555 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -48.55 -57.01 6.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.833 0.349 . . . . 54.51 111.02 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.92 -49.57 39.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.054 0.454 . . . . 70.44 110.625 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.501 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 14.8 t80 -54.61 -48.02 72.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.707 -0.678 . . . . 63.5 110.431 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.402 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 14.6 mt -63.98 -42.02 97.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.933 -0.576 . . . . 75.32 110.837 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.418 ' CB ' HD22 ' A' ' 44' ' ' LEU . . . -46.68 -40.29 12.96 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.187 -0.46 . . . . 71.12 111.05 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.413 ' HB3' ' CD2' ' A' ' 41' ' ' HIS . 0.6 OUTLIER -48.56 -50.13 33.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.806 -0.634 . . . . 73.24 111.09 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.413 ' CD2' ' HB3' ' A' ' 40' ' ' GLU . 5.3 m-70 -102.46 14.04 32.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.088 -0.505 . . . . 74.25 111.293 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.2 mttt 57.47 42.0 25.21 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.842 0.353 . . . . 74.55 110.959 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 19.8 mt -92.25 -22.43 19.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 74.4 111.463 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.418 HD22 ' CB ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -77.6 156.8 30.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.026 0.441 . . . . 72.53 111.23 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.31 -122.27 5.39 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.646 -0.707 . . . . 73.33 112.489 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -116.3 117.76 30.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.814 0.34 . . . . 74.44 110.964 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mp -45.97 -54.96 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.186 -0.461 . . . . 73.24 111.414 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.2 -37.81 16.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.9 -0.591 . . . . 71.03 111.075 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -85.77 -25.58 26.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.009 -0.541 . . . . 72.23 111.13 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 25.1 t -82.35 -25.82 8.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 75.41 111.423 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.21 -15.78 63.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.815 0.341 . . . . 72.3 111.189 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.12 -32.36 13.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 75.55 110.914 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.0 m -88.82 -33.6 17.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.326 -0.397 . . . . 73.53 111.053 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -91.96 125.34 36.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 72.0 111.191 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -82.09 175.83 10.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 73.11 110.602 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.9 tptt -58.42 -58.18 9.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.857 0.36 . . . . 73.54 110.587 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.0 -26.67 68.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.083 -0.508 . . . . 65.4 110.503 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -42.85 99.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.128 -0.487 . . . . 72.21 110.376 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 19.3 mt -71.6 -32.75 68.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.69 -0.686 . . . . 75.24 110.928 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 13.0 t -78.43 -42.29 26.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 74.25 110.94 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.3 m -59.41 -36.94 76.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.964 -0.562 . . . . 74.35 110.64 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.432 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -80.75 -22.17 40.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.019 -0.537 . . . . 75.11 110.999 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 21.6 t80 -83.78 -22.85 31.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 74.24 111.026 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -83.09 -54.73 4.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.279 -0.419 . . . . 74.35 111.545 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.501 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 4.2 p-80 -61.7 -29.13 69.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.098 -0.501 . . . . 71.0 111.366 -179.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.451 ' CD2' ' CD2' ' A' ' 72' ' ' PHE . 5.0 tt -51.98 -39.27 59.09 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.901 0.381 . . . . 74.24 111.118 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -78.81 -36.53 42.54 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.068 -0.514 . . . . 73.14 110.608 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.97 -39.87 83.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.961 -0.563 . . . . 73.43 110.745 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.68 -3.52 52.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.978 -0.556 . . . . 73.25 111.359 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.3 mmtp 48.5 38.97 11.99 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.752 0.31 . . . . 75.41 111.316 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -93.85 43.5 1.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.379 . . . . 64.05 111.111 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.451 ' CD2' ' CD2' ' A' ' 66' ' ' LEU . 86.4 m-85 -66.3 179.61 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.434 . . . . 74.34 110.889 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.9 tttt -75.15 153.01 38.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 72.41 110.893 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -120.87 -86.31 0.9 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.775 -0.726 . . . . 50.33 112.436 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -157.23 110.43 2.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.824 0.345 . . . . 72.34 110.944 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -141.57 148.64 39.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 73.14 110.896 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.4 t 60.28 73.32 0.49 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.129 -0.487 . . . . 71.44 110.939 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 7.1 pt -158.76 158.34 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.491 . . . . 74.4 111.144 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.65 89.11 5.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 75.44 110.875 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -81.26 146.46 30.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.182 -0.463 . . . . 74.44 110.891 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.2 m -112.41 144.69 19.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.146 -0.479 . . . . 75.44 111.111 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.9 t -114.03 -66.37 1.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.183 -0.462 . . . . 73.54 110.923 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -70.21 132.61 46.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 74.35 110.857 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -108.1 -31.47 7.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 73.34 110.902 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.7 p -115.67 147.0 19.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 74.3 111.075 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -106.57 -177.07 3.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 73.35 110.906 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -60.38 -179.77 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 71.32 110.868 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.5 t 63.5 109.08 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 72.12 111.138 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.9 tttp -70.04 84.99 0.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 74.1 110.884 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.1 tp -145.44 137.02 25.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 74.25 110.897 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -83.25 124.49 30.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 74.33 110.902 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -102.59 160.19 14.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.454 . . . . 74.44 110.927 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -127.06 138.48 53.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 71.24 110.872 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 28.5 mttm 60.22 85.41 0.18 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 75.24 110.872 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.87 147.02 61.25 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.54 2.16 . . . . 70.43 112.302 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -136.91 128.09 27.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 74.33 110.872 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -133.03 -76.68 0.49 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.467 . . . . 73.5 110.879 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 3.1 t -175.0 -40.38 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.966 -0.561 . . . . 72.24 110.878 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 2.7 tmtp? -92.76 110.18 21.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.105 -0.498 . . . . 74.1 110.906 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.6 p -138.42 152.6 48.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 74.41 110.895 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -160.28 35.5 0.17 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 72.24 110.929 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -81.03 138.5 36.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 74.42 110.927 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 58.2 p -140.73 147.92 39.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.434 . . . . 65.31 110.905 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.01 -36.93 8.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 73.14 110.905 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 59.31 -174.28 0.1 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.078 -0.51 . . . . 72.34 110.948 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -97.38 -32.98 11.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 74.43 110.873 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 164.43 62.31 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.725 -0.75 . . . . 73.12 112.468 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.9 168.01 24.29 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.565 2.177 . . . . 74.35 112.279 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.96 -168.01 0.26 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.58 2.187 . . . . 75.21 112.319 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.413 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -104.65 36.8 2.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 74.43 110.819 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -165.66 163.95 19.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 70.12 110.807 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 33.3 m -128.33 129.0 45.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.469 . . . . 75.4 110.668 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 8.0 tttm -128.88 151.47 49.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.31 -0.405 . . . . 61.53 110.972 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.4 m -150.27 123.14 8.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 70.03 110.872 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 29.8 t -80.37 106.33 11.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 75.12 111.454 -179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.5 mp -76.46 -59.99 2.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.143 -0.48 . . . . 73.42 110.497 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -112.94 108.05 16.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.93 -0.577 . . . . 62.01 110.681 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.8 mtmp? -60.97 142.86 56.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 73.03 110.969 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.403 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -110.44 -159.04 16.72 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.773 -0.727 . . . . 65.32 112.211 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -35.03 -46.71 0.33 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.814 0.34 . . . . 63.1 111.654 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 72.6 39.21 0.72 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 73.41 110.3 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -167.71 -42.68 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.686 -0.688 . . . . 71.41 110.423 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -84.71 86.4 7.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.018 -0.537 . . . . 75.13 110.669 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -106.0 155.54 38.23 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.044 -0.525 . . . . 65.0 110.822 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.25 125.53 11.99 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.537 2.158 . . . . 71.15 112.469 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.25 155.66 17.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.095 -0.502 . . . . 74.25 110.867 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 1.1 tptm -56.92 119.23 5.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 75.51 110.945 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 94.44 -9.41 71.73 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.721 -0.752 . . . . 74.01 112.758 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.27 140.15 29.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.871 0.367 . . . . 64.43 110.995 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.439 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 7.3 p -70.86 162.44 4.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.107 -0.497 . . . . 71.51 111.014 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.606 ' O ' ' HA ' ' A' ' 163' ' ' SER . 4.4 m -153.59 144.98 14.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.137 -0.483 . . . . 64.54 111.009 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.451 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.87 117.84 22.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.738 0.304 . . . . 73.41 110.763 179.528 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 30.3 p -150.21 168.94 22.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.077 0.465 . . . . 65.12 111.102 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.446 ' HB3' ' CD1' ' A' ' 149' ' ' ILE . 80.6 m95 -102.64 157.52 16.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.729 -0.669 . . . . 75.45 110.015 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 53.2 p90 -162.23 138.73 7.86 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.148 0.499 . . . . 73.23 112.055 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 22.1 m -131.35 116.23 17.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.478 -0.783 . . . . 73.24 110.335 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.572 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -98.16 145.17 17.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.601 -0.809 . . . . 63.12 113.291 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.9 143.24 27.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.832 0.349 . . . . 62.34 110.75 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 90.7 mt -88.64 -179.53 6.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 73.33 110.756 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -52.88 -45.14 67.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.301 -0.409 . . . . 74.01 111.075 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.0 -13.22 62.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.974 -0.557 . . . . 74.01 111.326 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 88.27 25.85 29.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.651 -0.785 . . . . 73.03 112.59 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -98.27 124.88 43.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.815 0.341 . . . . 74.21 110.817 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.2 t -63.7 129.41 27.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 72.12 111.085 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.416 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 54.1 p90 -110.83 -33.65 6.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 74.25 111.012 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . 0.414 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 13.9 m-20 -162.53 110.27 1.32 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 75.42 110.949 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 9.2 t -142.91 127.68 18.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 74.21 110.951 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 34.2 p-10 -92.71 52.58 1.89 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 75.04 110.385 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.446 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 27.9 mm -125.1 102.31 10.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.064 -0.516 . . . . 65.53 110.886 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -96.51 -75.69 0.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 74.11 110.943 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 69.4 p -146.37 165.99 27.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 73.12 110.93 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.12 -178.78 6.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.125 -0.489 . . . . 74.23 110.877 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -80.86 -29.06 35.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 53.35 111.142 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.67 -31.33 68.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.436 . . . . 75.32 110.989 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.12 -63.07 1.25 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 74.5 110.966 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 3.5 pttt -172.43 152.36 2.67 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.846 -0.615 . . . . 75.45 110.898 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 7.8 mmtp -66.18 78.26 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 73.13 110.894 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -153.37 43.15 0.59 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.479 . . . . 64.24 110.88 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.12 127.72 6.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 73.12 111.08 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.25 146.45 36.47 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.02 110.819 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.42 155.84 68.66 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.538 2.159 . . . . 72.33 112.234 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 3.6 tt -75.44 121.44 22.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.31 -0.404 . . . . 75.3 110.576 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.606 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.67 122.29 42.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.946 0.403 . . . . 73.13 111.305 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 10.8 p90 -151.81 143.67 23.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.909 -0.587 . . . . 75.15 110.557 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 4.6 mttp -80.96 138.71 36.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.079 0.466 . . . . 73.31 111.323 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.8 m -87.38 149.42 4.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.618 -0.719 . . . . 75.21 111.188 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.77 21.71 78.86 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.805 -0.712 . . . . 53.23 112.637 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 29.3 m -130.16 41.15 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.871 0.367 . . . . 75.44 111.134 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.47 38.58 5.34 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 121.125 -0.56 . . . . 74.23 113.154 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.69 -41.86 15.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.865 0.364 . . . . 73.13 110.95 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . 0.413 HG11 ' CE3' ' A' ' 175' ' ' TRP . 1.7 m -121.95 179.78 2.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.112 -0.494 . . . . 75.54 110.994 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.506 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -59.88 159.48 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.331 -0.395 . . . . 75.44 111.158 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -67.72 -28.26 67.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.204 -0.453 . . . . 75.32 111.139 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.5 -37.58 46.43 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.668 -0.777 . . . . 61.32 111.958 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.506 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.3 t90 -78.33 -33.48 49.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.919 0.39 . . . . 73.14 110.998 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -64.31 -33.87 76.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.967 -0.561 . . . . 75.33 110.444 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -78.65 -29.71 45.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 71.4 110.662 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -81.16 -45.47 16.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 71.21 111.105 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.494 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 11.8 mt -72.39 -18.92 61.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.016 -0.538 . . . . 74.25 111.167 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.3 tp -56.38 -24.18 42.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.429 -0.351 . . . . 75.34 111.345 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 16.2 p -114.5 18.09 16.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.627 -0.26 . . . . 75.3 111.618 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 3.5 mmm -68.13 103.48 1.56 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.869 0.366 . . . . 73.02 110.913 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.22 148.99 49.06 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.195 -0.457 . . . . 75.13 110.839 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 3.2 ttmt -54.85 115.77 2.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.506 . . . . 70.31 111.216 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 77.39 20.05 75.48 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.921 -0.656 . . . . 60.02 113.201 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . 0.403 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.6 tt0 -93.69 146.48 23.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.867 0.333 . . . . 73.3 111.032 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -119.22 136.23 54.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 74.44 109.936 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -150.57 176.25 11.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.106 0.479 . . . . 73.43 111.831 -179.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.88 133.52 33.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.604 -0.726 . . . . 73.22 109.477 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.442 ' CD2' ' CE1' ' A' ' 216' ' ' PHE . 1.6 pt? -140.07 141.53 36.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.135 0.493 . . . . 74.45 112.109 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -116.94 112.39 20.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.549 -0.75 . . . . 65.41 110.021 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . . . . . . . . . 1.3 mm -92.18 150.26 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.922 0.391 . . . . 74.31 111.214 -179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -83.37 166.4 35.04 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.525 . . . . 72.53 110.69 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -66.91 -14.76 44.95 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.532 2.155 . . . . 73.1 112.6 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -84.23 -31.18 25.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 72.54 111.034 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . 0.413 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 14.4 m0 -107.54 37.03 2.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.416 . . . . 74.22 111.075 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -154.44 -81.06 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 75.52 111.087 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.42 ' CE2' HD13 ' A' ' 208' ' ' ILE . 41.7 m-85 -106.11 -71.31 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.033 0.444 . . . . 74.13 110.762 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 151.34 176.56 24.28 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.721 -0.752 . . . . 71.25 112.597 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.31 -30.01 36.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.857 0.36 . . . . 74.42 110.798 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -49.73 19.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 74.44 110.686 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 107.35 -128.22 9.13 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.836 -0.697 . . . . 53.02 112.536 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . 0.413 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.0 OUTLIER -156.69 82.34 3.34 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.871 0.367 . . . . 73.43 110.753 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.57 -24.57 29.51 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.634 2.223 . . . . 71.3 112.481 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.42 -42.02 96.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.845 0.355 . . . . 75.41 111.027 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -103.53 28.83 6.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 70.25 111.257 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.43 29.8 15.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.268 -0.424 . . . . 73.43 111.023 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . 0.42 HD13 ' CE2' ' A' ' 198' ' ' TYR . 40.2 mt -90.49 111.68 48.77 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.219 -0.446 . . . . 71.23 111.07 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.21 170.89 19.14 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.527 2.151 . . . . 74.3 112.429 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.7 142.15 96.99 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.641 2.228 . . . . 71.13 112.177 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 47.82 76.67 0.11 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.356 -0.384 . . . . 75.4 111.116 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.08 113.56 17.91 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.357 -0.383 . . . . 75.34 111.581 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.57 126.84 29.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.134 -0.485 . . . . 75.12 110.253 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.417 HD12 ' CE2' ' A' ' 198' ' ' TYR . 13.0 mt -103.35 109.45 21.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.851 0.358 . . . . 72.13 111.556 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 20.5 m -103.26 136.85 42.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 71.32 110.617 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.572 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 29.3 p90 -155.38 176.3 12.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.061 0.458 . . . . 64.41 111.539 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -131.63 135.29 46.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.707 -0.679 . . . . 75.43 110.612 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 2.3 t -121.95 149.99 25.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.11 0.481 . . . . 73.43 111.924 -179.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -136.91 110.46 8.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.737 -0.665 . . . . 74.22 110.453 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.93 130.76 43.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.345 . . . . 70.22 110.897 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 18.3 t -110.25 -30.13 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.221 -0.445 . . . . 73.24 111.633 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -168.86 158.61 8.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.865 0.364 . . . . 62.42 111.069 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 3.4 mp -142.12 112.12 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 71.41 111.097 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-O 121.073 0.463 . . . . 73.15 110.826 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.7 mtt . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.851 0.357 . . . . 54.0 111.17 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.23 175.47 0.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 72.11 111.09 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -174.25 40.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 71.33 111.114 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -81.63 172.82 12.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 63.22 111.08 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.407 ' CG1' ' CG2' ' A' ' 136' ' ' THR . 33.2 t -60.04 110.81 3.14 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.139 -0.482 . . . . 74.45 111.044 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.428 ' HD2' ' CE2' ' A' ' 72' ' ' PHE . 92.4 Cg_endo -78.98 139.56 15.36 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.607 2.205 . . . . 71.4 112.428 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -80.62 151.87 28.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.168 -0.469 . . . . 74.32 110.827 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.82 92.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.2 -0.455 . . . . 73.54 111.299 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.89 -35.45 76.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 71.05 111.027 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 2.4 m-90 -114.62 173.68 6.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.087 -0.506 . . . . 73.53 110.866 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -118.25 154.33 32.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.081 -0.509 . . . . 73.32 110.644 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 43.7 t -55.13 -34.28 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.353 -0.385 . . . . 54.15 110.927 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -65.01 -32.38 74.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.108 -0.496 . . . . 72.51 110.839 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -82.05 -56.1 4.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.346 -0.388 . . . . 73.24 110.835 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.3 mt -50.21 -28.75 8.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.202 -0.454 . . . . 75.12 110.82 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -94.63 -28.7 15.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.766 -0.652 . . . . 72.43 110.337 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.4 t -53.12 170.2 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.881 -0.6 . . . . 74.44 111.314 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -103.69 17.11 24.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.733 -0.667 . . . . 73.33 111.123 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -113.65 -20.66 11.12 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.489 -0.323 . . . . 75.34 111.357 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.2 tt -84.78 129.48 56.61 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.591 -0.277 . . . . 73.43 110.959 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -77.23 125.64 7.97 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.5 2.133 . . . . 55.51 112.255 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -24.1 66.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 74.42 110.952 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.26 -35.21 62.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.282 -0.417 . . . . 75.34 111.465 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.26 -54.48 6.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.966 0.413 . . . . 64.25 111.046 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.428 HD13 HG23 ' A' ' 25' ' ' ILE . 29.1 mt -45.0 -32.9 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 64.21 111.38 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 6.1 mt -76.51 -49.97 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 74.32 110.925 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 34.8 mttm -64.8 -25.57 67.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.812 -0.631 . . . . 75.24 111.115 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -70.4 -45.38 66.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.997 0.427 . . . . 75.24 110.834 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.4 mt -69.97 -36.48 75.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.851 -0.613 . . . . 74.02 110.946 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -69.59 -20.72 63.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.176 -0.465 . . . . 73.14 110.707 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.2 -51.06 5.35 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.148 -0.478 . . . . 72.34 110.963 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -88.87 0.91 56.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 71.52 111.612 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.38 160.45 14.33 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.673 -0.775 . . . . 71.13 112.445 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -92.55 151.87 19.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.547 0.213 . . . . 71.24 110.458 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.94 -57.12 6.98 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.81 0.338 . . . . 73.22 111.176 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -47.78 -51.65 21.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.059 0.457 . . . . 62.23 110.842 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.508 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 10.8 t80 -52.76 -47.51 67.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.82 -0.627 . . . . 73.24 110.477 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.413 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 11.2 mt -66.32 -40.88 90.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.073 -0.512 . . . . 72.33 110.764 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.431 ' CB ' HD21 ' A' ' 44' ' ' LEU . . . -47.83 -47.51 31.3 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.056 0.455 . . . . 71.13 111.079 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -57.64 -26.91 62.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.765 -0.652 . . . . 74.03 110.895 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 43.9 m-70 -112.63 11.16 19.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.276 -0.42 . . . . 75.3 111.261 179.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt 51.15 35.47 13.3 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.858 0.361 . . . . 74.33 110.93 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 29.1 mt -94.18 -20.34 19.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.132 -0.485 . . . . 73.45 111.736 -179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.431 HD21 ' CB ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.69 158.76 26.89 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.046 0.45 . . . . 71.33 111.121 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 114.57 -119.37 4.67 Favored Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 115.798 -0.637 . . . . 75.24 112.404 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -116.34 113.79 23.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.751 0.31 . . . . 74.21 110.9 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mp -45.58 -54.64 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.192 -0.458 . . . . 74.42 111.374 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.27 -36.55 9.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.87 -0.605 . . . . 72.24 110.92 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -85.64 -25.23 26.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.992 -0.549 . . . . 74.53 111.102 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.7 t -83.45 -25.81 7.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.297 -0.41 . . . . 73.42 111.479 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.0 -15.83 63.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.37 -0.377 . . . . 73.33 111.41 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -95.19 -34.02 12.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.818 0.342 . . . . 74.1 110.999 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.8 t -87.94 -30.56 19.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.46 . . . . 65.51 111.081 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.45 125.8 37.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.427 . . . . 73.32 111.132 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.09 174.84 10.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 71.25 110.642 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -58.1 9.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.861 0.363 . . . . 73.21 110.505 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.59 -26.99 68.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.121 -0.491 . . . . 75.34 110.573 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.91 -43.4 98.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.095 -0.502 . . . . 70.44 110.475 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 20.4 mt -73.48 -32.64 64.41 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.713 -0.676 . . . . 73.41 110.973 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 15.9 t -76.9 -42.39 32.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.005 0.431 . . . . 74.55 110.695 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.0 m -60.73 -33.44 72.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.869 -0.605 . . . . 73.34 110.516 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.13 -22.25 39.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.483 . . . . 75.32 111.045 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -83.66 -22.9 32.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.099 -0.5 . . . . 73.11 111.126 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -83.95 -54.16 5.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.046 0.45 . . . . 74.3 111.294 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.508 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 3.1 p-80 -60.78 -31.09 70.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.02 -0.536 . . . . 65.11 111.036 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.449 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.7 tt -46.1 -41.12 11.89 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.899 0.381 . . . . 64.14 111.162 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -78.13 -42.14 32.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.018 -0.537 . . . . 74.31 110.268 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -70.03 -13.07 62.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.853 -0.612 . . . . 70.05 110.933 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.444 ' N ' ' O ' ' A' ' 65' ' ' HIS . 35.8 p -108.72 -16.07 14.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.179 -0.464 . . . . 71.25 111.195 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.29 30.65 17.11 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.793 0.33 . . . . 75.32 110.942 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -96.1 44.27 1.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 74.44 111.047 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.431 ' CD2' HD22 ' A' ' 66' ' ' LEU . 75.5 m-85 -66.86 175.95 2.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 75.33 110.696 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.36 147.45 44.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 74.32 110.879 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 164.18 148.37 5.41 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.696 -0.764 . . . . 73.54 112.514 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.6 p 56.29 103.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.859 0.361 . . . . 74.33 111.007 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -176.94 -39.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 71.32 110.935 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.92 134.83 6.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.097 -0.501 . . . . 71.34 110.926 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 23.9 mt -112.56 151.81 14.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 75.53 111.102 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.5 m -72.56 126.52 30.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 64.32 110.911 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.85 148.97 29.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 74.04 110.903 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -85.6 129.07 38.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 71.03 111.135 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.7 m -103.09 144.17 31.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 73.13 110.924 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.56 148.7 27.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.155 -0.475 . . . . 74.25 110.883 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 60.46 110.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 75.25 110.925 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.7 t -108.19 145.48 15.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 75.33 111.068 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -74.26 -55.78 5.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 74.04 110.888 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 23.3 m-20 -87.92 141.62 28.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 71.4 110.887 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.3 m -107.73 108.41 25.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 74.4 111.136 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.64 34.6 20.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 75.31 110.929 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.1 tp -108.98 143.6 38.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 74.41 110.927 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 60.8 111.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 72.32 110.92 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -104.22 159.51 15.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 73.12 110.913 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -177.56 -39.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 75.34 110.94 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.3 tptt -162.55 79.93 1.8 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.083 -0.508 . . . . 74.22 110.877 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -52.23 121.47 8.97 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.587 2.191 . . . . 51.1 112.356 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 62.0 151.29 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 75.31 110.929 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -109.98 -32.12 7.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 71.32 110.873 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.0 t 43.43 69.37 0.41 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.159 -0.473 . . . . 74.31 111.474 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -84.13 118.74 24.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 74.32 110.908 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 83.6 p -151.0 -175.41 5.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 65.24 110.932 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -143.91 35.49 1.26 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.223 -0.444 . . . . 74.4 110.905 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -146.14 101.92 3.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 63.21 110.914 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 69.9 p -110.11 -32.88 6.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 74.31 110.937 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.4 mp -108.32 151.07 26.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 75.41 110.868 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -137.89 31.27 2.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 75.31 110.917 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -110.58 -32.32 6.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 64.1 110.918 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 136.44 69.99 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.727 -0.749 . . . . 74.42 112.502 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.77 154.59 67.52 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.591 2.194 . . . . 75.15 112.324 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.424 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 55.8 Cg_endo -70.16 -166.78 0.21 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.565 2.177 . . . . 74.1 112.284 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.416 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -97.66 30.61 2.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.274 -0.421 . . . . 72.54 110.987 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.424 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 31.7 p90 -152.36 171.5 17.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.307 -0.406 . . . . 73.1 110.88 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.409 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 0.2 OUTLIER -134.52 129.22 34.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 75.41 110.56 179.828 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.32 151.54 39.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 74.2 111.056 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.3 m -150.08 114.1 5.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.144 -0.48 . . . . 71.44 110.875 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 9.7 p -80.7 106.6 12.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.249 -0.432 . . . . 75.35 111.134 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.4 mp -78.31 -77.11 0.17 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.476 . . . . 72.32 111.076 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -96.76 110.0 22.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.267 -0.424 . . . . 74.11 111.08 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.2 mtmt -59.43 139.6 56.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.804 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.507 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -111.68 -154.78 12.88 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.682 -0.77 . . . . 73.42 112.659 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -37.29 -52.92 1.09 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.049 0.452 . . . . 65.43 111.412 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 tmtp? 71.85 36.17 1.24 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.793 -0.64 . . . . 74.04 110.234 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -156.91 -44.61 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.791 -0.64 . . . . 73.35 110.775 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -87.59 97.08 10.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.117 -0.492 . . . . 74.44 110.919 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -109.41 154.82 42.04 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.089 -0.505 . . . . 75.13 110.642 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.59 125.47 11.2 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.515 2.143 . . . . 73.14 112.439 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.1 tttm -92.99 160.22 14.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 75.22 110.899 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -57.89 119.47 6.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.286 -0.415 . . . . 73.11 110.947 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 87.45 1.8 83.21 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.745 -0.74 . . . . 75.11 112.833 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -92.13 139.41 30.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.878 0.37 . . . . 74.33 110.967 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.413 ' CG2' ' N ' ' A' ' 131' ' ' VAL . 4.4 p -71.66 162.04 4.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.066 -0.515 . . . . 75.03 110.909 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.629 ' O ' ' HA ' ' A' ' 163' ' ' SER . 9.3 m -154.56 145.58 13.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.042 -0.526 . . . . 71.52 110.987 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.452 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -128.35 117.95 22.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.728 0.299 . . . . 75.05 110.936 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.419 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 29.1 p -154.26 170.3 21.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.919 0.39 . . . . 65.54 111.196 -179.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.428 ' CE3' HG13 ' A' ' 149' ' ' ILE . 66.3 m95 -104.19 161.01 14.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.938 -0.574 . . . . 74.52 110.149 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.415 ' CD1' ' N ' ' A' ' 135' ' ' TYR . 4.5 p90 -159.5 134.98 8.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.03 0.443 . . . . 73.42 111.702 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.407 ' CG2' ' CG1' ' A' ' 5' ' ' VAL . 22.5 m -127.83 113.55 16.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 72.03 110.307 179.467 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.574 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.18 144.2 17.06 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.629 -0.796 . . . . 61.25 113.342 -179.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.44 130.77 13.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.756 0.312 . . . . 72.52 110.457 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 91.3 mt -66.02 -178.0 0.56 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.395 -0.366 . . . . 73.21 110.849 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -56.7 -42.3 78.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 75.33 110.76 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.46 -5.22 56.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.97 -0.559 . . . . 73.11 111.395 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 95.89 25.76 12.62 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.624 -0.798 . . . . 65.12 112.634 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.89 113.02 18.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.876 0.37 . . . . 74.41 110.837 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 11.3 p -71.6 121.42 21.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 73.42 111.136 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.427 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 53.3 p90 -113.28 -17.08 12.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 71.32 111.315 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.09 127.52 7.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.797 0.332 . . . . 73.42 110.951 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.87 98.01 3.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 75.54 111.005 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -77.26 -9.16 58.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.224 -0.444 . . . . 73.52 111.075 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.465 ' CD1' ' N ' ' A' ' 149' ' ' ILE . 2.5 mp -94.54 117.76 39.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.383 -0.371 . . . . 62.55 110.962 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -106.06 -73.38 0.68 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.455 . . . . 72.1 110.89 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 4.1 m -145.53 166.01 26.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 61.52 110.902 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 94.4 p -77.2 166.45 23.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 73.42 110.92 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.0 -31.01 34.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 74.25 111.123 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 13.0 mmmt -59.94 -31.49 69.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 65.04 110.969 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 2.5 tptp -88.67 -33.58 17.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.462 . . . . 75.43 110.895 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -176.83 148.57 0.68 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 74.35 110.855 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -88.63 89.63 8.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 75.51 110.923 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 58.8 m-20 -158.83 45.99 0.3 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 73.41 110.831 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.11 114.43 3.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 74.41 111.092 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -129.83 128.4 22.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 74.22 110.89 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.09 148.2 40.65 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.411 2.074 . . . . 74.2 112.314 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.409 HD21 ' CD1' ' A' ' 164' ' ' PHE . 0.3 OUTLIER -73.47 120.76 19.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 70.12 110.532 179.797 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.629 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -103.55 122.7 45.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.944 0.402 . . . . 73.51 111.336 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . 0.415 ' CE2' HG22 ' A' ' 171' ' ' VAL . 25.2 p90 -153.74 145.58 23.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.002 -0.544 . . . . 74.44 110.637 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -80.75 138.49 36.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.128 0.489 . . . . 73.52 111.29 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 17.8 m -87.27 149.35 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.652 -0.704 . . . . 73.24 111.05 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.0 23.7 76.91 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.777 -0.725 . . . . 74.42 112.408 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -132.55 39.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.939 0.4 . . . . 73.02 110.926 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 47.36 38.77 13.34 Favored Glycine 0 C--N 1.33 0.202 0 C-N-CA 121.02 -0.609 . . . . 61.22 112.85 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.5 -47.05 11.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.915 0.388 . . . . 74.4 110.872 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . 0.415 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.2 OUTLIER -120.08 -179.68 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.96 -0.564 . . . . 74.35 111.022 179.898 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.488 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 4.0 pt -59.64 161.02 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.32 -0.4 . . . . 74.44 111.285 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -69.07 -27.88 66.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 75.2 110.986 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.83 -37.75 38.29 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.673 -0.775 . . . . 62.3 112.03 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.488 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.7 t90 -78.44 -33.43 48.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.921 0.391 . . . . 74.44 111.09 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -69.05 -29.05 67.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.973 -0.558 . . . . 64.41 110.695 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -81.76 -28.72 33.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 75.42 110.827 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -85.27 -51.55 6.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.277 -0.42 . . . . 73.24 111.212 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.449 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 2.9 mt -54.39 -36.71 64.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.991 -0.55 . . . . 75.14 110.773 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 3.1 tp -54.15 -25.02 20.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 73.31 110.996 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.16 -0.0 57.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 62.4 111.445 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 23.2 mmm -80.54 150.14 29.7 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.867 0.365 . . . . 62.24 110.909 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.52 171.08 8.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.104 -0.498 . . . . 71.31 111.18 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 3.6 tttt -62.7 117.1 5.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.037 -0.529 . . . . 74.42 110.68 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . 0.401 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 69.07 65.63 2.54 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.617 -0.802 . . . . 72.41 112.398 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . 0.507 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.5 tt0 -145.05 145.14 31.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.663 0.268 . . . . 63.0 110.503 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.9 ttpt -118.36 135.88 54.06 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.194 -0.299 . . . . 73.12 110.194 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -144.43 172.82 12.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.125 0.488 . . . . 73.31 111.864 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.52 118.22 14.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.53 -0.759 . . . . 72.41 109.817 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.42 ' CD2' ' CE1' ' A' ' 216' ' ' PHE . 2.1 pt? -128.73 139.84 52.02 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.016 0.436 . . . . 74.53 111.795 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.79 114.87 23.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.792 -0.64 . . . . 75.24 110.544 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.428 HD13 ' CZ ' ' A' ' 216' ' ' PHE . 3.1 mt -105.0 142.43 18.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.229 -0.441 . . . . 75.2 111.521 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.426 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.3 OUTLIER -72.05 168.57 21.78 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.907 -0.588 . . . . 74.25 110.592 179.818 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . 0.426 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 24.7 Cg_endo -61.93 -35.07 79.56 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.352 2.035 . . . . 73.5 112.224 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -60.37 -39.91 88.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 71.12 111.099 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . 0.416 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 16.8 m0 -96.98 36.87 1.36 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.343 -0.39 . . . . 64.0 110.974 -179.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -160.8 -78.45 0.05 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.067 -0.515 . . . . 74.43 110.742 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.428 ' CE2' ' CD1' ' A' ' 208' ' ' ILE . 36.0 m-85 -105.98 -71.25 0.75 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 74.34 110.535 179.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 141.03 -177.21 21.11 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.815 -0.707 . . . . 51.51 112.85 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 18.4 mttm -59.21 -34.65 72.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.816 0.341 . . . . 72.43 110.932 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -61.57 -52.8 62.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 73.3 110.64 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 97.17 173.6 34.29 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.874 -0.679 . . . . 73.22 112.551 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . 0.417 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.3 OUTLIER -111.23 93.51 18.61 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.654 0.264 . . . . 75.22 110.743 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.97 -26.37 51.32 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.527 2.151 . . . . 64.43 112.443 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -60.86 -42.18 97.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.946 0.403 . . . . 74.43 110.849 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -99.21 27.43 5.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.043 -0.526 . . . . 75.34 111.231 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.1 29.44 14.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.27 -0.423 . . . . 74.02 111.038 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . 0.428 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 40.6 mt -94.14 111.46 53.39 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.317 -0.401 . . . . 74.53 110.987 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.33 172.32 6.65 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.554 2.169 . . . . 74.21 112.25 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.2 128.64 12.31 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.612 2.208 . . . . 73.53 112.241 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 63.26 69.54 0.57 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.3 -0.409 . . . . 53.14 110.711 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.68 156.98 34.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 75.42 111.39 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -88.57 141.72 28.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.962 -0.563 . . . . 73.22 110.381 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.416 HD11 ' CE2' ' A' ' 198' ' ' TYR . 3.5 mt -125.68 109.07 12.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.379 . . . . 71.23 111.518 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 4.3 m -113.07 142.9 45.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.953 -0.567 . . . . 63.13 110.511 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.574 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 18.4 p90 -155.08 -179.86 8.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.438 . . . . 74.54 111.371 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -132.53 135.96 46.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.702 -0.681 . . . . 73.4 110.409 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 4.2 t -121.14 150.9 24.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.098 0.475 . . . . 74.23 111.809 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -136.74 107.96 6.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.654 -0.703 . . . . 72.32 110.163 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . 0.419 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 2.3 tt -69.99 130.0 41.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.426 -0.352 . . . . 73.32 110.809 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 24.7 t -108.8 -30.14 2.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.253 -0.43 . . . . 73.23 111.423 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -170.0 160.16 8.1 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.901 0.381 . . . . 70.4 111.236 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 31.9 mt -142.83 111.82 2.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.03 -0.532 . . . . 75.32 111.014 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.243 -0.435 . . . . 74.43 110.902 179.98 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 mpp? . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.826 0.346 . . . . 72.21 111.207 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -175.13 116.31 0.16 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 71.41 111.092 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.431 ' O ' ' CB ' ' A' ' 4' ' ' ALA . . . -67.35 -177.28 0.68 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.227 -0.442 . . . . 72.32 111.118 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.431 ' CB ' ' O ' ' A' ' 3' ' ' ALA . . . 163.23 86.47 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.11 -0.496 . . . . 74.35 111.065 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.0 t -87.61 110.76 37.07 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.521 -0.309 . . . . 73.24 110.846 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.451 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 88.9 Cg_endo -80.9 140.2 12.6 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.622 2.215 . . . . 75.41 112.623 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -83.87 154.62 23.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 75.44 110.863 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.57 89.92 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.114 -0.493 . . . . 70.13 111.47 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.83 -32.38 67.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 74.45 111.18 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.455 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 1.9 m-90 -118.63 173.86 6.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 74.33 110.927 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -116.66 153.08 32.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.962 -0.563 . . . . 70.25 110.424 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 24.1 t -55.96 -33.74 36.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.926 0.394 . . . . 55.11 111.009 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -71.13 -27.67 63.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.986 -0.552 . . . . 73.23 111.286 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.34 -56.38 3.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.811 0.339 . . . . 73.35 111.208 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mt -49.51 -65.07 0.63 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.245 -0.434 . . . . 62.14 111.228 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.0 mtt180 -53.55 -25.1 15.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 75.35 111.258 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.69 172.72 0.16 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.941 0.401 . . . . 72.31 111.239 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -110.3 16.84 21.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.92 -0.582 . . . . 53.4 111.254 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -111.34 -23.58 10.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.568 -0.287 . . . . 71.52 111.224 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.455 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 10.1 tt -87.12 116.52 66.35 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.458 -0.337 . . . . 75.05 110.921 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.45 123.27 13.22 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.384 2.056 . . . . 75.4 112.237 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.4 -24.11 66.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 74.42 111.308 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -53.16 -35.24 59.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.421 -0.354 . . . . 70.12 111.295 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -77.56 -49.74 14.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.287 -0.415 . . . . 72.11 110.921 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.436 HG23 HD11 ' A' ' 25' ' ' ILE . 25.1 mt -47.03 -36.91 3.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.898 -0.592 . . . . 72.23 111.246 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 10.7 mt -72.04 -49.26 45.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 72.32 110.848 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.23 -23.43 48.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.69 -0.687 . . . . 71.42 111.098 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -74.23 -49.78 21.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.002 0.43 . . . . 73.5 111.061 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.5 mt -66.3 -28.55 68.77 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.872 -0.603 . . . . 73.55 111.291 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -76.21 -28.01 57.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.52 -0.309 . . . . 73.33 111.016 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.424 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 10.7 pt-20 -89.91 -38.48 13.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.832 0.348 . . . . 71.32 110.817 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.451 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 42.4 m170 -100.49 16.61 24.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 73.23 110.982 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.6 152.11 21.49 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.831 -0.7 . . . . 63.44 112.512 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.8 p -92.73 156.52 16.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.642 0.258 . . . . 75.42 110.604 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -48.0 -54.68 12.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.765 0.316 . . . . 70.2 111.31 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 82.5 p -51.06 -46.69 61.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.023 0.439 . . . . 75.33 110.695 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 22.2 t80 -57.11 -48.18 79.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.745 -0.661 . . . . 64.14 110.775 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.429 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 11.8 mt -63.24 -46.87 84.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 71.53 110.909 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -49.46 -31.05 9.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 71.24 111.243 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -72.92 -32.46 65.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 71.21 111.073 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.413 ' CG ' ' HB1' ' A' ' 62' ' ' ALA . 6.7 m-70 -110.14 12.14 23.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.377 -0.374 . . . . 75.44 111.548 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 59.96 32.13 20.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.747 0.308 . . . . 74.2 111.01 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.5 mt -85.93 -22.05 27.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.257 -0.429 . . . . 74.12 111.042 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.429 ' N ' ' HB3' ' A' ' 38' ' ' LEU . 92.4 mt -48.01 170.47 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.931 0.396 . . . . 63.24 111.234 179.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.88 -160.13 32.15 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.846 -0.692 . . . . 64.44 112.796 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -102.62 147.11 27.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.963 0.411 . . . . 74.13 111.065 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mp -45.36 -43.59 3.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.889 -0.596 . . . . 74.34 111.513 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -43.15 72.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.981 -0.554 . . . . 75.21 111.047 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -85.68 -28.95 24.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.956 -0.565 . . . . 73.24 111.22 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.8 t -73.01 -27.57 24.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.299 -0.41 . . . . 74.14 111.454 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.51 -25.86 66.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.427 -0.351 . . . . 54.35 111.359 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.25 -27.38 15.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.287 -0.415 . . . . 75.31 111.244 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.4 m -84.33 -21.43 30.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.353 -0.385 . . . . 74.33 111.414 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -120.58 131.48 54.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.795 0.331 . . . . 74.23 111.349 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -77.81 -178.12 5.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 74.22 110.474 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -58.42 8.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.816 0.341 . . . . 74.52 110.536 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.24 -26.72 67.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.143 -0.481 . . . . 72.45 110.664 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.67 -37.95 83.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.108 0.48 . . . . 72.4 110.249 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 14.2 mt -76.25 -31.71 58.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.614 -0.721 . . . . 74.23 110.955 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 15.1 t -78.46 -42.81 26.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.051 0.453 . . . . 71.34 110.705 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 32.8 m -59.27 -35.6 74.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.842 -0.617 . . . . 72.51 110.493 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.413 ' HB1' ' CG ' ' A' ' 41' ' ' HIS . . . -81.76 -20.85 38.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.024 -0.535 . . . . 74.24 110.957 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.413 ' CD1' ' O ' ' A' ' 63' ' ' TYR . 8.2 t80 -83.67 -22.99 31.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.194 -0.457 . . . . 75.33 110.86 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -85.6 -53.91 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 74.24 111.369 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.449 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.2 p-80 -60.99 -28.29 68.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.111 -0.495 . . . . 73.53 111.136 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.437 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.8 tt -50.27 -40.51 48.35 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.977 0.417 . . . . 72.13 110.973 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.418 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.4 m-85 -78.95 -37.48 39.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.892 -0.594 . . . . 63.31 110.578 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.04 -40.47 91.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.893 -0.594 . . . . 74.31 110.999 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.01 -9.53 48.29 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.076 -0.511 . . . . 71.54 111.278 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.59 33.73 19.79 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.741 0.305 . . . . 75.53 111.244 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -90.56 46.29 1.32 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.387 -0.37 . . . . 74.15 111.078 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.428 ' CE2' ' HD2' ' A' ' 6' ' ' PRO . 93.3 m-85 -67.32 169.77 8.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.293 -0.412 . . . . 75.25 110.742 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.1 ttmm -66.59 125.94 27.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.329 -0.396 . . . . 70.21 110.861 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -96.99 27.97 15.92 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.703 -0.76 . . . . 73.33 112.527 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.14 178.93 0.09 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.832 0.349 . . . . 70.21 110.859 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -157.46 -45.16 0.07 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.193 -0.458 . . . . 73.31 110.941 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 63.9 p -126.86 122.1 33.73 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.061 -0.518 . . . . 75.51 110.914 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 8.1 pt -159.46 -42.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.474 . . . . 75.04 111.259 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 14.6 m -154.36 105.81 2.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.114 -0.493 . . . . 62.33 110.903 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -104.57 -178.54 3.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 74.43 110.896 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 27.7 t 63.93 116.56 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 72.15 111.056 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 79.6 p -160.9 -48.66 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 54.04 110.904 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -164.95 98.61 0.75 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 75.51 110.871 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.81 162.81 23.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 74.51 110.941 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -126.42 96.66 3.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 73.43 111.11 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.18 141.73 36.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 73.13 110.831 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -103.01 -32.89 9.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 71.21 110.922 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 15.2 m -89.86 153.08 3.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.445 . . . . 72.34 111.15 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -104.73 64.52 0.74 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 64.55 110.845 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -111.28 -33.22 6.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.459 . . . . 74.21 110.918 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -106.35 -31.73 8.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.473 . . . . 60.42 110.927 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -78.82 126.28 30.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.455 . . . . 74.2 110.865 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -163.72 151.73 13.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 75.11 110.929 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.0 mttt 60.14 78.61 0.32 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 74.1 110.873 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.35 -27.38 30.93 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.574 2.183 . . . . 75.13 112.342 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 7.0 tptm -70.65 -35.38 72.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 73.51 110.903 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 59.3 107.95 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.171 -0.468 . . . . 73.3 110.954 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 12.1 p -129.95 110.17 11.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.444 . . . . 73.23 110.905 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.2 -31.38 7.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 74.31 110.897 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.8 m -96.64 -169.68 1.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 74.41 110.887 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -172.19 -41.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 74.32 110.869 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -88.82 -178.52 5.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.091 -0.504 . . . . 54.12 110.912 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.9 m -161.76 154.42 20.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 73.02 110.899 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.5 mp -97.49 169.61 9.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 75.31 110.926 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -151.97 -169.58 3.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 54.3 110.858 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 63.78 -80.21 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 75.44 111.021 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 135.57 91.65 0.35 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.803 -0.713 . . . . 34.1 112.469 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.89 166.54 27.42 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.593 2.195 . . . . 72.32 112.317 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.409 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 32.9 Cg_exo -57.85 -158.35 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.627 2.218 . . . . 73.02 112.31 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.26 39.13 1.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.271 -0.422 . . . . 75.52 110.893 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.409 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 6.2 p90 -173.03 153.82 2.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 64.13 110.897 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 19.7 m -115.85 130.55 56.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.276 -0.42 . . . . 72.22 110.327 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 4.6 tttt -127.65 144.85 51.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.926 0.393 . . . . 74.52 111.227 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.3 m -142.51 119.81 11.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 74.52 110.681 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 27.5 t -80.29 106.36 11.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.431 . . . . 73.22 111.211 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.402 ' CD2' ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -79.33 -49.36 12.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.214 -0.448 . . . . 75.12 110.795 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -121.8 107.99 12.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 75.34 110.957 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.6 mttm -63.03 143.63 57.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.223 -0.444 . . . . 71.44 110.895 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -106.15 -165.05 23.0 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.687 -0.768 . . . . 72.5 112.409 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -36.56 -42.57 0.36 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.846 0.355 . . . . 64.22 111.826 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.6 tttt 74.55 42.22 0.31 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.135 -0.484 . . . . 74.54 110.582 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 69.1 m -164.26 -43.37 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.946 -0.57 . . . . 71.34 110.722 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -86.83 101.12 13.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 72.11 110.911 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -120.24 147.67 45.47 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 72.23 110.834 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.37 127.63 26.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.56 2.174 . . . . 75.3 112.547 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -99.18 152.19 20.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 75.12 110.706 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.48 114.05 1.52 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.335 -0.393 . . . . 74.53 111.114 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 93.44 -2.37 70.64 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.762 -0.732 . . . . 72.31 112.982 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -92.15 137.77 32.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.919 0.39 . . . . 72.43 111.071 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.434 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 7.5 p -70.05 161.27 4.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.078 -0.51 . . . . 75.52 110.971 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.623 ' O ' ' HA ' ' A' ' 163' ' ' SER . 5.5 m -153.58 144.71 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 75.22 111.07 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.475 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.96 117.75 22.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.543 -0.299 . . . . 65.13 110.805 179.753 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.405 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 30.2 p -150.12 168.09 24.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.0 0.429 . . . . 74.14 111.182 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.457 ' HB3' ' CD1' ' A' ' 149' ' ' ILE . 51.3 m95 -101.89 157.76 16.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.813 -0.63 . . . . 75.1 109.747 179.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.46 ' CE1' ' CB ' ' A' ' 148' ' ' ASN . 49.8 p90 -162.45 139.06 7.78 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.296 -0.561 . . . . 74.13 112.22 -179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 81.1 m -129.26 112.48 13.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.466 -0.788 . . . . 73.22 110.457 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.617 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.73 146.15 18.11 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.598 -0.81 . . . . 72.11 113.184 -179.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -152.21 147.1 26.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.789 0.328 . . . . 74.21 110.833 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 41.4 mt -80.5 -178.37 6.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 74.14 110.694 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -56.92 -43.82 81.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.901 0.382 . . . . 71.13 111.018 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.7 -6.61 47.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.996 -0.547 . . . . 65.4 111.462 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 92.43 20.45 35.04 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.666 -0.778 . . . . 63.54 112.729 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.48 113.8 25.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 73.11 110.675 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 5.7 m -63.68 138.5 22.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 74.14 111.134 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.421 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 40.3 p90 -117.81 -40.96 2.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 60.51 110.929 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -154.53 115.2 3.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.067 -0.515 . . . . 75.03 110.715 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 6.9 t -142.76 126.97 17.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.302 -0.408 . . . . 72.34 111.237 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . 0.46 ' CB ' ' CE1' ' A' ' 135' ' ' TYR . 22.3 t30 -89.01 55.44 3.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.196 0.522 . . . . 75.33 109.915 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.457 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 45.3 mm -131.62 96.45 2.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.74 -0.664 . . . . 74.41 111.05 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -90.6 -75.32 0.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 74.43 110.912 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 4.6 m -146.5 165.98 27.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 61.03 110.946 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.4 m -89.26 171.01 10.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 74.02 110.89 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.02 -30.59 34.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 71.12 111.086 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -59.66 -31.82 69.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 74.24 110.943 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -86.92 -34.72 19.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 74.44 110.917 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -177.66 139.47 0.24 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 74.35 110.918 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.29 74.16 2.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 74.21 110.864 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -146.77 61.23 1.2 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 73.41 110.86 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -150.68 139.16 20.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.15 -0.477 . . . . 73.24 111.094 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.4 tttt -146.34 116.06 4.65 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.446 . . . . 60.21 110.855 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . 0.42 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 53.8 Cg_exo -52.41 155.05 10.31 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.376 2.05 . . . . 74.53 112.258 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.65 117.83 16.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 75.41 110.517 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.623 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -100.6 123.31 44.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.939 0.399 . . . . 74.45 111.474 -179.733 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 11.7 p90 -153.38 145.41 23.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.965 -0.561 . . . . 73.31 110.528 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 9.6 mtpt -81.17 138.9 35.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.136 0.493 . . . . 75.33 111.248 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 6.2 m -87.3 149.37 4.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.566 -0.743 . . . . 70.25 111.128 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.63 22.82 78.04 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.836 -0.697 . . . . 74.34 112.6 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 28.0 m -131.24 40.52 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.35 . . . . 74.14 111.111 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.52 38.06 6.94 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 121.071 -0.585 . . . . 53.03 113.135 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.51 -47.0 11.81 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.94 0.4 . . . . 75.22 110.983 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -119.0 -179.48 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.001 -0.545 . . . . 75.2 111.026 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.506 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.8 158.89 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.316 -0.402 . . . . 74.23 111.281 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 17.0 ttm105 -67.73 -27.88 67.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.271 -0.422 . . . . 75.13 110.965 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.1 -38.06 48.17 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.694 -0.765 . . . . 72.11 111.881 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.506 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.2 t90 -78.6 -33.0 47.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.993 0.425 . . . . 74.11 110.883 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.91 -32.17 73.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.877 -0.601 . . . . 73.21 110.538 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -80.84 -28.93 35.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.055 -0.52 . . . . 71.31 110.665 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -80.7 -56.36 4.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 65.33 111.059 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.449 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 6.2 mt -56.01 -31.3 62.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.924 -0.58 . . . . 73.23 110.797 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.4 tp -53.41 -28.88 32.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.085 -0.507 . . . . 72.34 111.344 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 27.1 p -105.65 4.59 30.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.372 -0.376 . . . . 74.52 111.793 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 5.3 mtp -74.33 101.98 4.23 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.903 0.383 . . . . 75.15 110.89 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.9 161.39 18.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.927 -0.579 . . . . 74.44 111.409 -179.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.86 117.65 5.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.56 -0.745 . . . . 74.13 111.2 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 81.65 10.42 84.33 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.869 -0.682 . . . . 64.05 113.137 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -86.18 151.07 23.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 71.21 111.27 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -127.42 138.16 52.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.998 -0.546 . . . . 75.2 109.976 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.05 172.5 13.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.226 0.536 . . . . 75.34 112.147 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.82 101.09 4.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.391 -0.822 . . . . 75.13 109.715 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -122.18 147.94 45.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.121 0.486 . . . . 74.03 111.881 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -120.47 120.53 36.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.705 -0.68 . . . . 73.1 110.564 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.471 ' CD1' ' CZ ' ' A' ' 216' ' ' PHE . 5.0 mp -100.49 139.46 21.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 74.23 111.347 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -77.0 164.88 56.41 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.933 -0.576 . . . . 74.22 110.756 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.93 -42.0 73.25 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.588 2.192 . . . . 72.34 112.303 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -52.29 -30.41 27.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 72.03 111.379 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . . . . . . . . . 23.7 m0 -115.6 36.95 3.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.404 -0.362 . . . . 74.32 111.227 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -154.93 -85.2 0.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.447 -0.342 . . . . 73.22 111.25 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.421 ' CE2' HG13 ' A' ' 208' ' ' ILE . 28.7 m-85 -107.55 -33.47 7.32 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.043 0.449 . . . . 75.44 110.624 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 109.29 173.1 20.95 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.912 -0.661 . . . . 53.54 112.821 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -32.57 70.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.788 0.328 . . . . 74.44 110.831 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -56.78 -54.71 43.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.203 -0.453 . . . . 64.33 110.643 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 117.87 -162.4 13.08 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.833 -0.699 . . . . 72.02 112.673 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . 0.419 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 1.6 tm0? -153.02 84.99 4.37 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.85 0.357 . . . . 70.23 110.355 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -48.67 -49.67 14.26 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.803 2.335 . . . . 74.42 113.048 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -50.93 -42.32 59.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.914 0.388 . . . . 72.14 111.088 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -95.65 26.75 3.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.033 -0.53 . . . . 73.35 111.384 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 4.0 mptt 47.84 30.68 1.99 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.83 0.348 . . . . 73.24 111.075 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . 0.421 HG13 ' CE2' ' A' ' 198' ' ' TYR . 22.7 mm -92.81 111.71 52.48 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 74.25 111.28 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.99 160.88 39.67 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.414 2.076 . . . . 75.31 112.17 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -51.33 115.3 1.98 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.473 2.115 . . . . 73.23 112.298 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 66.24 73.53 0.37 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.232 -0.44 . . . . 62.34 110.912 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -126.22 124.68 40.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.248 -0.433 . . . . 74.03 111.329 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 3.8 tptm -65.67 151.82 45.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.106 -0.497 . . . . 72.51 110.578 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.411 HD11 ' CE2' ' A' ' 198' ' ' TYR . 6.1 mt -130.48 109.42 10.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.814 0.34 . . . . 73.33 111.405 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 3.8 m -106.38 139.72 40.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 63.11 110.573 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.617 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 6.4 p90 -156.44 178.75 9.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.107 0.48 . . . . 75.22 111.514 -179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -133.01 137.13 46.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.613 -0.721 . . . . 74.34 110.279 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 2.3 t -124.15 151.26 29.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.107 0.48 . . . . 72.25 112.086 -178.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -136.88 110.98 8.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.598 -0.728 . . . . 64.11 110.132 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . 0.405 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 2.9 tt -70.83 128.04 34.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.84 0.352 . . . . 73.32 110.988 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 15.5 t -104.97 -30.43 2.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.125 -0.488 . . . . 63.34 111.571 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -171.21 162.46 6.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.867 0.365 . . . . 74.31 111.239 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 30.2 mt -143.49 112.23 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.006 -0.543 . . . . 70.13 110.964 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 72.44 110.89 179.999 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 mpp? . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.873 0.368 . . . . 75.13 111.189 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -147.87 165.19 31.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 74.43 111.118 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.64 174.48 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 74.12 111.099 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 69.78 158.55 0.17 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.188 -0.46 . . . . 74.25 111.058 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 38.5 t -95.17 114.19 63.19 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 75.41 111.217 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -77.12 132.89 13.04 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.731 2.287 . . . . 72.25 112.401 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 7.2 mm100 -79.79 146.54 32.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 73.43 110.943 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.412 ' HG3' ' CE2' ' A' ' 67' ' ' PHE . 0.0 OUTLIER -50.81 115.63 1.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.036 -0.529 . . . . 74.32 111.192 -179.829 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -89.25 -39.39 13.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.226 -0.443 . . . . 70.11 110.871 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.416 ' CD1' HD21 ' A' ' 20' ' ' LEU . 1.5 m-90 -104.36 160.05 15.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.023 -0.535 . . . . 72.14 110.703 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 m -99.26 151.87 20.55 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.048 -0.524 . . . . 74.52 110.533 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.444 ' O ' ' CG ' ' A' ' 16' ' ' ARG . 44.0 t -56.67 -37.0 50.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.922 0.392 . . . . 75.52 110.437 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.419 ' O ' ' HB2' ' A' ' 17' ' ' SER . 2.1 tt0 -66.02 -27.4 68.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.962 -0.563 . . . . 75.52 110.86 179.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.413 ' O ' ' HB2' ' A' ' 17' ' ' SER . 6.3 mt-30 -80.08 -54.53 5.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.985 -0.552 . . . . 74.42 111.564 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.417 HD12 ' CD2' ' A' ' 63' ' ' TYR . 2.0 mt -50.07 -66.69 0.35 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.727 0.298 . . . . 72.41 111.797 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.444 ' CG ' ' O ' ' A' ' 12' ' ' VAL . 1.5 ptm180 -60.59 -26.21 66.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.383 -0.371 . . . . 73.44 111.371 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.419 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 0.4 OUTLIER -50.85 177.28 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.928 0.394 . . . . 73.42 111.273 -179.92 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.19 16.68 21.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.946 -0.57 . . . . 74.43 111.107 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -117.6 -19.32 9.44 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.418 -0.356 . . . . 75.44 111.273 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.416 HD21 ' CD1' ' A' ' 10' ' ' TRP . 1.6 tm? -84.58 121.74 74.87 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.508 -0.315 . . . . 71.22 110.852 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.84 123.25 10.49 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.428 2.086 . . . . 62.34 112.369 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.4 ' HB2' ' CD1' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -66.15 -24.23 66.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.11 -0.495 . . . . 75.31 111.403 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -53.43 -45.56 69.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.411 -0.358 . . . . 75.34 111.494 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.98 -23.29 48.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.162 -0.472 . . . . 72.11 111.475 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 57.1 mt -70.74 -43.22 77.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.925 0.393 . . . . 74.23 111.127 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.0 mt -68.72 -40.19 81.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.017 -0.538 . . . . 73.43 111.102 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -67.18 -25.83 66.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.001 -0.545 . . . . 75.04 111.062 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -70.04 -43.76 70.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.033 0.444 . . . . 73.31 110.875 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.8 mt -72.79 -21.35 61.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.888 -0.597 . . . . 74.42 111.04 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -82.68 -24.13 33.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.412 -0.358 . . . . 75.0 111.029 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.82 1.65 31.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.374 -0.375 . . . . 74.33 111.417 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -131.86 -10.66 3.45 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.687 0.255 . . . . 75.24 111.687 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.81 167.66 12.48 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.738 -0.744 . . . . 51.31 112.41 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.7 p -93.86 149.87 20.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.58 0.229 . . . . 74.12 110.489 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.07 -56.98 6.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.807 0.337 . . . . 74.55 110.994 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.2 m -48.41 -50.7 29.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 75.44 110.832 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.487 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 17.6 t80 -54.06 -48.03 71.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.853 -0.612 . . . . 75.23 110.492 179.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 13.2 mt -66.71 -41.79 87.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.094 -0.503 . . . . 72.31 110.784 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.429 ' CB ' HD22 ' A' ' 44' ' ' LEU . . . -47.57 -47.71 28.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.989 0.423 . . . . 73.0 111.206 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -57.51 -27.22 62.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.812 -0.631 . . . . 74.44 110.982 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -112.53 9.81 19.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.314 -0.403 . . . . 65.34 111.231 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.4 37.77 28.27 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.94 0.4 . . . . 72.13 110.664 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 17.7 mt -95.94 -19.74 19.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.986 -0.552 . . . . 75.21 111.851 -179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.429 HD22 ' CB ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -82.11 155.76 24.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.078 0.466 . . . . 74.21 111.101 -179.853 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.37 -122.63 5.5 Favored Glycine 0 N--CA 1.452 -0.292 0 CA-C-N 115.648 -0.705 . . . . 74.43 112.429 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.0 m-80 -116.34 115.43 25.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.736 0.303 . . . . 74.22 111.059 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.5 mp -44.85 -53.5 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.178 -0.465 . . . . 75.1 111.447 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.56 -37.2 7.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.868 -0.605 . . . . 75.44 111.05 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -85.69 -26.58 25.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 72.11 111.255 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.4 t -82.79 -26.56 8.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.432 -0.349 . . . . 72.54 111.597 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.95 -17.85 64.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.427 -0.351 . . . . 61.34 111.454 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 ptpt -95.06 -31.96 13.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.445 -0.343 . . . . 74.22 111.09 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -87.88 -33.68 18.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.24 -0.436 . . . . 75.21 111.131 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -91.21 128.58 37.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.29 -0.414 . . . . 71.21 111.239 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -84.88 178.63 7.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 71.04 110.678 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -60.03 -58.1 10.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.91 0.386 . . . . 75.34 110.653 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -27.4 69.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.072 -0.513 . . . . 63.54 110.522 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.02 -41.45 96.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 72.52 110.431 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.4 ' CD1' ' HB2' ' A' ' 22' ' ' LYS . 20.3 mt -75.55 -30.15 59.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.7 -0.682 . . . . 75.11 110.99 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 18.8 t -78.26 -42.91 27.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.305 -0.407 . . . . 73.5 110.93 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.7 m -61.98 -33.92 75.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.948 -0.569 . . . . 74.13 110.792 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.41 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -80.86 -23.49 39.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 62.14 111.107 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.417 ' CD2' HD12 ' A' ' 15' ' ' LEU . 71.8 t80 -83.66 -22.86 32.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 74.11 110.953 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -82.88 -54.65 4.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.048 -0.524 . . . . 63.54 111.373 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.487 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 3.4 p-80 -63.0 -26.0 68.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.072 -0.513 . . . . 74.32 111.433 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.435 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.6 tt -54.57 -39.04 67.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.847 0.356 . . . . 73.1 111.026 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.412 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 5.2 m-85 -78.98 -38.16 37.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.106 -0.497 . . . . 70.32 110.574 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.63 -40.53 84.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.97 -0.559 . . . . 70.03 110.78 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 75.1 p -90.34 -4.66 56.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.95 -0.568 . . . . 75.22 111.467 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 48.36 37.73 9.19 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.703 0.287 . . . . 71.23 111.287 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.414 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 41.2 mtt180 -94.25 44.03 1.11 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.38 -0.373 . . . . 75.25 111.115 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.416 ' CD2' HD21 ' A' ' 66' ' ' LEU . 81.5 m-85 -65.69 -178.29 0.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 62.42 110.783 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -72.31 153.01 41.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.289 -0.414 . . . . 74.11 110.948 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -130.56 164.97 22.89 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.722 -0.751 . . . . 63.22 112.47 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 79.0 p -60.25 152.37 24.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.75 0.309 . . . . 75.34 110.928 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -144.39 -46.78 0.25 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 73.3 110.994 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.4 m -123.58 125.73 45.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.996 -0.547 . . . . 62.24 110.899 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 3.9 mp -112.15 -33.28 2.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.182 -0.463 . . . . 74.21 111.142 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.47 160.36 15.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 64.4 110.912 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.24 -33.59 6.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 72.23 110.892 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.0 m -118.07 146.71 22.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 70.12 111.129 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.8 m -176.65 138.02 0.28 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 65.43 110.928 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 60.78 158.66 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 75.44 110.946 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 61.19 154.8 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 63.43 110.962 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -165.9 102.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.896 -0.593 . . . . 74.31 111.095 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.8 ttpp -143.96 138.45 28.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.209 -0.45 . . . . 75.2 110.9 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -176.63 97.38 0.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 74.21 110.939 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 20.5 t 63.82 141.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.464 . . . . 74.11 111.065 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.35 -34.03 10.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.479 . . . . 73.12 110.917 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.08 -31.12 65.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 75.41 110.921 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -133.86 175.97 8.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 74.41 110.878 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -176.38 131.42 0.22 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.47 . . . . 63.13 110.889 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -132.52 161.52 33.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 73.3 110.869 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.9 mttt -106.25 86.53 2.11 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 72.21 110.883 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.02 143.21 48.89 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.572 2.181 . . . . 55.33 112.286 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.58 140.04 40.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 74.5 110.88 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -132.25 139.99 48.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 74.43 110.893 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.6 t -104.47 142.74 34.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 74.21 110.971 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -108.23 -31.5 7.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 74.01 110.905 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.1 m -96.9 177.21 5.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 74.05 110.897 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -176.59 105.1 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 74.12 110.875 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -150.12 -177.51 5.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 75.01 110.921 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 6.2 m 63.59 126.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.165 -0.471 . . . . 70.14 110.922 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.74 -168.87 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 73.04 110.873 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -110.17 -31.47 7.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.196 -0.456 . . . . 74.42 110.894 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -78.67 -33.23 47.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 74.01 110.919 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 96.8 67.68 0.95 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.765 -0.731 . . . . 75.52 112.49 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -68.96 171.27 13.87 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.615 2.21 . . . . 71.34 112.284 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.419 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 31.4 Cg_endo -63.87 -166.73 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.581 2.187 . . . . 73.54 112.258 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.42 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -97.84 30.07 3.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 74.54 110.987 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.419 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 45.0 p90 -154.89 -176.81 6.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 74.43 110.81 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -161.46 104.93 1.26 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.332 -0.394 . . . . 73.4 110.733 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.7 ptmm? -98.46 151.4 20.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.983 0.42 . . . . 73.54 111.241 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 2.1 m -148.61 111.67 4.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.887 -0.597 . . . . 74.51 110.391 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 26.1 t -73.58 106.29 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.305 -0.407 . . . . 75.52 111.324 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.5 mp -75.54 -32.02 60.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 73.24 110.508 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.7 tttt -140.35 110.47 6.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.036 -0.529 . . . . 75.22 110.668 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.0 tptt -57.99 134.76 56.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.262 -0.426 . . . . 75.11 110.968 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.505 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -108.63 -155.08 17.23 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.713 -0.756 . . . . 75.32 112.425 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -36.07 -53.44 0.78 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.008 0.432 . . . . 73.2 111.445 -179.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 70.87 33.71 2.12 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.816 -0.629 . . . . 73.51 110.248 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 62.7 m -154.51 -45.13 0.09 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.753 -0.658 . . . . 70.21 110.683 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -89.08 92.57 9.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.119 -0.492 . . . . 74.22 110.84 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -102.83 154.91 37.18 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.117 -0.492 . . . . 75.31 110.847 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 125.5 12.23 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.522 2.148 . . . . 64.33 112.332 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.44 152.42 18.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 75.12 110.925 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.48 118.98 6.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 74.14 110.859 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 97.36 -16.04 61.28 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.699 -0.763 . . . . 74.22 112.606 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -84.09 140.41 31.83 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.876 0.369 . . . . 74.0 110.969 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.461 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 8.4 p -71.04 163.45 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 75.25 111.041 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.613 ' O ' ' HA ' ' A' ' 163' ' ' SER . 13.0 m -154.91 146.26 13.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.171 -0.468 . . . . 74.44 111.063 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.492 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -128.01 117.76 22.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.718 0.294 . . . . 75.1 110.838 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.426 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 26.1 p -155.27 170.18 22.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.927 0.394 . . . . 64.41 111.047 -179.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.419 ' CZ2' ' HG3' ' A' ' 161' ' ' PRO . 38.2 m95 -106.08 164.6 11.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.949 -0.569 . . . . 74.22 110.308 179.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.464 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 12.3 p90 -162.08 137.07 7.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.926 0.394 . . . . 71.41 111.433 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.06 114.07 16.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.949 -0.568 . . . . 74.21 110.466 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.588 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.64 144.78 17.44 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.615 -0.802 . . . . 73.51 113.407 -179.184 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.95 136.78 18.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.702 0.286 . . . . 74.23 110.367 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 17.1 mt -68.45 -179.05 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.857 0.36 . . . . 75.04 111.035 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -57.04 -41.78 79.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.025 -0.534 . . . . 75.14 110.862 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.37 0.99 39.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 64.23 111.446 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 91.48 25.83 22.34 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.645 -0.788 . . . . 74.53 112.619 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.95 108.35 16.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.773 0.32 . . . . 75.3 110.835 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 11.3 p -68.81 125.34 26.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 65.02 111.138 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.429 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 21.3 p90 -109.96 -22.2 11.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 74.2 111.002 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -162.06 137.9 7.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.401 -0.363 . . . . 75.15 110.836 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 52.3 m -142.8 106.25 4.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 75.22 111.016 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . 0.464 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 13.8 t30 -82.11 -14.81 55.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 74.44 111.226 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.41 ' HA ' ' CE3' ' A' ' 134' ' ' TRP . 25.4 mm -54.53 149.47 2.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.822 0.344 . . . . 73.33 111.096 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.27 166.05 29.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 72.24 110.898 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 40.9 p -60.18 165.99 3.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.264 -0.426 . . . . 64.12 110.914 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.1 t -75.82 165.13 25.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 73.31 110.856 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.02 -30.56 34.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 74.1 111.104 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.49 -31.4 69.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 74.52 110.945 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 19.8 tptt -84.36 -31.54 24.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.913 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -175.06 122.39 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.449 . . . . 72.34 110.905 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -71.09 80.67 0.68 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 74.15 110.862 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -160.98 47.32 0.21 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 71.54 110.876 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.16 127.13 6.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.17 -0.468 . . . . 73.22 111.038 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -145.01 135.29 11.9 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 73.03 110.887 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . 0.419 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 52.6 Cg_exo -54.68 163.49 3.86 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.445 2.097 . . . . 73.42 112.276 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.452 ' CD2' ' CD1' ' A' ' 164' ' ' PHE . 2.4 tt -84.54 119.41 25.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 72.42 110.595 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.613 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -95.17 121.79 37.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.897 0.379 . . . . 45.53 111.175 -179.93 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . 0.452 ' CD1' ' CD2' ' A' ' 162' ' ' LEU . 8.2 p90 -149.1 140.68 23.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.082 -0.508 . . . . 74.54 110.742 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 56.1 mttt -80.68 137.41 36.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.076 0.465 . . . . 73.12 111.118 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 5.8 m -87.36 149.8 3.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.668 -0.696 . . . . 75.24 111.13 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.19 22.92 77.53 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.836 -0.697 . . . . 54.42 112.576 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 30.2 m -132.92 40.9 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.896 0.379 . . . . 61.03 111.032 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 49.12 38.85 26.0 Favored Glycine 0 CA--C 1.517 0.218 0 C-N-CA 120.936 -0.649 . . . . 71.53 112.896 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 3.1 mmtt -83.02 -46.5 12.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.901 0.381 . . . . 75.4 110.78 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . 0.417 HG12 ' CE3' ' A' ' 175' ' ' TRP . 0.2 OUTLIER -123.35 -179.06 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.923 -0.581 . . . . 74.43 110.923 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.48 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 4.4 pt -57.16 161.37 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.316 -0.402 . . . . 64.33 111.382 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 31.8 ttm180 -69.7 -25.43 63.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 73.51 111.036 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -78.63 -38.55 23.98 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.743 -0.742 . . . . 61.23 112.187 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.48 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 3.4 t90 -75.66 -32.36 60.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.902 0.382 . . . . 74.32 111.36 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -72.04 -33.54 68.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.038 -0.528 . . . . 64.54 110.817 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -74.52 -28.98 61.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.115 -0.493 . . . . 63.13 110.83 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -87.98 -50.69 6.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.272 -0.422 . . . . 63.01 111.257 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.479 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 8.4 mt -52.55 -37.12 57.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.078 -0.51 . . . . 74.24 110.885 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 6.9 tp -50.97 -26.17 5.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.097 -0.501 . . . . 74.44 111.418 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.52 3.04 55.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.345 . . . . 75.12 111.624 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 4.7 ttt -79.95 148.99 30.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.752 0.311 . . . . 63.43 110.879 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -118.38 169.68 9.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.427 . . . . 73.52 111.26 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.76 118.52 8.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.859 -0.61 . . . . 73.0 110.659 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 68.01 64.1 3.31 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.687 -0.768 . . . . 60.33 112.476 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . 0.505 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 14.2 tt0 -144.02 147.7 34.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.575 0.226 . . . . 72.01 110.5 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 6.1 tttt -115.94 132.83 56.53 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.066 -0.346 . . . . 74.14 110.066 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.57 170.34 15.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.072 0.463 . . . . 73.25 111.729 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.08 101.39 7.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.653 -0.703 . . . . 72.05 109.892 179.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.414 ' HB2' ' CE1' ' A' ' 216' ' ' PHE . 4.9 mp -99.32 118.17 35.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.044 0.45 . . . . 75.3 112.106 -178.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -110.72 107.71 17.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.666 -0.697 . . . . 73.2 109.574 178.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.435 HG12 ' CE2' ' A' ' 216' ' ' PHE . 3.6 mm -98.29 141.77 15.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.012 0.434 . . . . 74.01 111.639 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -81.53 166.66 36.65 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.868 -0.606 . . . . 73.11 110.372 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -60.84 -48.72 9.96 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.427 2.084 . . . . 74.53 112.302 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -51.62 -26.32 8.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 54.52 111.442 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . 0.42 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 10.1 m0 -117.61 37.02 4.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.487 -0.324 . . . . 75.44 111.216 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -158.01 -82.9 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.5 -0.318 . . . . 72.22 111.471 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.433 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 22.7 m-85 -99.61 -30.36 12.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.855 0.36 . . . . 75.42 111.021 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 103.31 175.46 26.29 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.811 -0.709 . . . . 74.11 112.67 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 7.9 ttmt -57.6 -40.05 78.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.881 0.372 . . . . 74.32 110.848 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -44.6 96.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.059 -0.519 . . . . 70.22 110.607 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 109.14 -154.31 16.53 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.851 -0.69 . . . . 70.32 112.487 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . 0.423 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.6 OUTLIER -139.82 87.3 12.91 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.718 0.294 . . . . 73.32 110.703 179.932 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.11 -22.12 67.64 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.54 2.16 . . . . 74.41 112.471 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.61 -42.11 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.882 0.372 . . . . 73.25 110.866 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -109.79 23.32 14.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.112 -0.494 . . . . 72.12 111.401 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt 56.36 54.4 7.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 74.44 111.067 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . 0.402 HG23 ' CD2' ' A' ' 198' ' ' TYR . 20.2 mm -110.57 111.71 57.0 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 74.33 111.055 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.08 161.05 7.14 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.43 2.086 . . . . 63.43 112.342 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.18 129.35 15.97 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.594 2.196 . . . . 75.24 112.313 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 67.86 37.09 3.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.335 -0.393 . . . . 73.4 110.918 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -91.75 157.45 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.256 -0.429 . . . . 72.21 111.326 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.5 155.97 18.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 75.12 110.507 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.433 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 32.4 mt -136.21 109.26 7.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.905 0.383 . . . . 75.54 111.314 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 38.6 m -109.71 137.04 48.09 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.075 -0.511 . . . . 74.23 110.941 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.588 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 13.7 p90 -153.6 178.02 10.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 75.12 111.039 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -134.07 137.64 44.77 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.926 -0.579 . . . . 70.12 110.541 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.75 150.97 23.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.131 0.491 . . . . 74.13 111.976 -178.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -136.72 107.58 6.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.612 -0.722 . . . . 75.31 109.953 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 221' ' ' VAL . 1.0 OUTLIER -70.84 130.57 42.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.433 -0.349 . . . . 70.21 110.913 -179.672 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . 0.433 ' N ' HD22 ' A' ' 220' ' ' LEU . 25.3 t -107.35 -31.47 2.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.351 -0.386 . . . . 72.54 111.465 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -169.56 160.58 9.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.884 0.373 . . . . 75.03 111.235 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 44.7 mt -140.56 110.02 3.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.111 -0.495 . . . . 75.32 111.028 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 73.51 110.911 179.928 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.867 0.365 . . . . 74.41 111.222 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.38 168.28 1.58 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 64.42 111.108 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -144.97 108.41 4.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 74.25 111.152 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 59.6 89.81 0.06 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 60.45 111.138 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.2 t -60.07 111.27 3.7 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.185 -0.461 . . . . 75.32 110.965 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.454 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 73.7 Cg_endo -76.48 136.44 17.5 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.654 2.236 . . . . 75.53 112.382 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -80.66 152.91 28.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.453 . . . . 74.14 110.867 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.7 114.55 1.18 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 72.44 111.173 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -87.75 -38.49 15.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.092 -0.503 . . . . 73.44 110.843 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.424 ' CD1' HD11 ' A' ' 20' ' ' LEU . 1.7 m-90 -112.79 173.69 6.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.955 -0.566 . . . . 74.1 110.708 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -115.09 150.86 35.3 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.063 -0.517 . . . . 75.05 110.69 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.2 t -56.04 -32.81 34.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.012 0.434 . . . . 73.22 110.668 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -75.62 -24.68 56.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.803 -0.635 . . . . 74.21 110.969 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.04 -57.46 3.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.85 0.357 . . . . 75.24 110.803 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.66 -63.41 1.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.28 -0.418 . . . . 71.33 110.952 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -53.84 -24.38 15.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 74.45 111.194 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.9 177.46 0.15 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.009 0.433 . . . . 74.14 111.255 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.38 17.08 21.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.826 -0.625 . . . . 71.21 111.151 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -106.83 -24.76 11.96 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.527 -0.306 . . . . 65.32 111.263 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.424 HD11 ' CD1' ' A' ' 10' ' ' TRP . 6.3 tt -93.98 117.8 67.21 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.517 -0.31 . . . . 74.42 111.051 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.07 127.2 23.35 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.419 2.079 . . . . 73.53 112.076 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -24.13 67.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 75.1 111.162 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -53.91 -39.73 66.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.343 -0.389 . . . . 74.11 111.523 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -73.74 -55.09 6.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.896 0.379 . . . . 70.33 111.015 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.419 HD13 HG22 ' A' ' 25' ' ' ILE . 28.7 mt -44.71 -33.65 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.862 -0.608 . . . . 75.41 111.379 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 6.8 mt -76.02 -39.87 37.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 74.3 110.868 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.2 mtpt -72.15 -26.15 61.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.976 -0.556 . . . . 73.01 111.044 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.486 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 33.8 t80 -69.57 -44.63 70.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.05 0.452 . . . . 75.12 110.742 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 mt -71.7 -24.39 61.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.705 -0.68 . . . . 72.41 110.992 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -76.38 -24.11 54.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.298 -0.41 . . . . 73.24 110.703 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -103.39 -10.19 18.82 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.253 -0.43 . . . . 73.51 111.125 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.486 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 12.1 m170 -116.58 -11.2 11.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.405 -0.361 . . . . 72.54 111.324 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -121.06 165.27 14.15 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.708 -0.758 . . . . 61.32 112.42 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -92.6 150.88 20.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.606 0.241 . . . . 74.25 110.515 179.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -48.9 -57.08 7.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.758 0.313 . . . . 61.52 110.941 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.5 m -47.94 -51.97 21.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.018 0.437 . . . . 75.31 110.736 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.493 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 12.5 t80 -52.94 -47.4 68.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.745 -0.662 . . . . 74.22 110.277 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 14.1 mt -65.36 -40.69 93.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.915 -0.584 . . . . 74.42 110.674 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.4 ' CB ' HD23 ' A' ' 44' ' ' LEU . . . -49.59 -43.25 46.2 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.227 -0.442 . . . . 73.22 111.063 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -58.01 -29.32 65.2 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.868 -0.606 . . . . 73.43 110.74 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 -112.82 12.02 19.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 75.53 111.102 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 54.44 37.45 27.76 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.866 0.365 . . . . 74.35 110.748 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.3 mt -94.37 -20.95 19.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 74.34 111.895 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.4 HD23 ' CB ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -78.15 155.53 30.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.099 0.476 . . . . 75.25 111.153 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.92 -124.67 6.1 Favored Glycine 0 N--CA 1.451 -0.302 0 CA-C-N 115.638 -0.71 . . . . 75.25 112.43 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -116.4 119.31 35.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.796 0.331 . . . . 73.33 110.969 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mp -45.69 -52.56 2.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.17 -0.468 . . . . 74.03 111.4 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -47.7 -37.09 12.34 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.909 -0.587 . . . . 74.22 110.842 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -85.58 -26.6 26.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.866 -0.606 . . . . 73.21 110.931 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.5 t -78.59 -26.06 13.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.238 -0.437 . . . . 64.5 111.345 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.33 -25.39 67.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.428 -0.351 . . . . 74.54 111.103 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -95.17 -27.62 15.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 71.31 110.803 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -100.32 33.84 2.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.486 . . . . 74.4 111.012 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -166.76 135.57 2.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 75.02 110.984 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -94.63 177.7 5.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.271 -0.422 . . . . 72.21 110.974 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.62 -57.82 10.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.315 -0.402 . . . . 74.33 110.929 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.54 -26.94 64.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.057 -0.519 . . . . 72.31 110.602 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -63.01 -45.69 91.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.023 -0.535 . . . . 75.13 110.793 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 23.9 mt -73.82 -29.03 61.92 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.714 -0.675 . . . . 75.43 111.202 -179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.1 t -81.08 -43.98 20.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.901 0.382 . . . . 71.32 111.057 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.0 m -59.95 -33.14 71.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.971 -0.559 . . . . 71.43 110.695 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.423 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -84.46 -23.12 30.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 72.52 111.129 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -83.78 -23.03 31.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.257 -0.429 . . . . 71.3 110.981 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 42.9 m-20 -81.79 -55.07 4.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 75.23 111.419 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.493 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 4.2 p-80 -61.65 -29.8 70.3 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.153 -0.476 . . . . 71.23 111.296 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.428 HD23 ' CD2' ' A' ' 72' ' ' PHE . 5.1 tt -50.2 -40.01 45.88 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.891 0.377 . . . . 64.32 111.194 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -79.03 -38.75 35.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.52 . . . . 74.41 110.695 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.45 -41.15 93.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.941 -0.572 . . . . 75.14 110.768 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.2 p -92.64 -2.61 55.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.936 -0.574 . . . . 73.31 111.462 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.13 38.77 10.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.768 0.318 . . . . 74.31 111.353 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.424 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 45.3 mtt-85 -93.13 43.68 1.13 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.308 -0.406 . . . . 72.31 110.992 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.428 ' CD2' HD23 ' A' ' 66' ' ' LEU . 89.8 m-85 -64.5 178.71 0.7 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 75.43 110.826 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.4 ttmm -68.79 153.03 44.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.28 -0.418 . . . . 75.25 110.923 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.02 -102.47 2.8 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.731 -0.747 . . . . 74.33 112.494 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.46 95.14 1.99 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.83 0.347 . . . . 73.2 110.913 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -110.66 -33.05 6.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 73.33 110.913 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.23 100.43 10.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 62.2 110.924 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 2.1 pt -158.57 170.78 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 72.42 111.192 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.5 m -65.47 -31.5 72.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.234 -0.439 . . . . 74.43 110.9 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 25.1 mtpt 60.67 111.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 65.43 110.885 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 27.3 t -99.51 -31.29 3.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 74.33 111.105 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.7 m -97.77 164.89 12.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.461 . . . . 73.23 110.919 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -106.54 169.9 8.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 75.51 110.868 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 60.47 31.88 20.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 74.52 110.839 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 19.8 t 69.09 -67.7 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.179 -0.464 . . . . 74.02 111.226 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -129.32 157.87 40.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.957 -0.565 . . . . 72.41 110.909 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 15.2 m-20 -145.86 109.39 4.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.186 -0.461 . . . . 73.11 110.945 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.8 m -110.33 -30.27 2.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.435 . . . . 74.35 111.17 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.71 -31.37 11.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.444 . . . . 74.22 110.921 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.4 tp -91.53 102.69 15.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.437 . . . . 63.31 110.909 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -129.52 139.5 51.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 74.02 110.883 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -109.1 -35.65 6.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 74.11 110.935 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -177.42 37.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 72.12 110.927 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 60.62 88.73 0.12 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 72.14 110.849 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -68.87 116.56 4.52 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.514 2.143 . . . . 74.03 112.307 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -91.01 163.75 14.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.469 . . . . 74.34 110.877 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -118.04 128.45 54.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 71.22 110.902 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.7 m -123.13 147.31 46.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.479 . . . . 73.43 110.887 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -177.66 -39.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 75.22 110.937 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 73.6 m 60.69 159.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.104 -0.498 . . . . 74.51 110.966 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -168.99 74.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 75.3 110.849 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -156.44 173.75 16.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 72.05 110.928 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.0 p -147.31 108.84 4.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 73.11 110.879 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 tt -108.27 152.13 25.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 75.44 110.948 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -164.27 -44.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 74.43 111.003 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -122.11 -40.84 2.47 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.09 -0.505 . . . . 74.23 110.954 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 136.57 77.73 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.803 -0.713 . . . . 61.35 112.516 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -69.38 171.05 14.73 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.574 2.183 . . . . 75.23 112.311 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.423 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 32.3 Cg_endo -64.29 -166.19 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.59 2.194 . . . . 74.55 112.253 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.426 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -97.17 30.22 2.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 71.21 111.018 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.423 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 20.3 p90 -157.83 161.93 38.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.299 -0.409 . . . . 74.52 110.84 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 12.2 m -131.46 103.49 6.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 71.4 111.043 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 13.8 tttm -109.59 151.49 26.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 74.24 110.705 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 2.1 m -143.31 128.47 18.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 62.11 110.874 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 9.2 p -78.55 106.34 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.247 -0.433 . . . . 75.35 111.14 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.8 mp -78.94 -78.01 0.16 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.208 -0.451 . . . . 74.23 110.79 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -86.73 108.07 18.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 73.4 110.753 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.44 121.88 12.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.47 . . . . 73.32 111.049 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -100.03 -159.52 28.41 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.74 -0.743 . . . . 71.35 112.139 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 121' ' ' LYS . 0.5 OUTLIER -36.11 -48.87 0.63 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.876 0.369 . . . . 73.02 111.572 -179.479 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 120' ' ' ASP . 20.6 mtpt 67.58 36.9 3.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.845 -0.616 . . . . 75.12 110.349 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -153.91 -44.91 0.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.758 -0.656 . . . . 74.34 110.676 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -88.86 98.47 11.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.14 -0.482 . . . . 74.12 110.853 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -110.61 146.19 33.85 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 72.41 110.842 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.56 125.55 19.35 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.511 2.141 . . . . 63.44 112.453 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.99 152.22 20.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.109 -0.496 . . . . 74.51 110.8 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -55.22 111.59 0.89 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.243 -0.435 . . . . 71.42 110.881 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 99.8 -10.82 60.79 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.742 -0.742 . . . . 60.11 112.708 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -86.92 134.49 33.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.877 0.37 . . . . 70.33 110.953 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.407 ' CG2' ' N ' ' A' ' 131' ' ' VAL . 7.1 p -70.65 163.38 3.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 73.11 110.989 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.617 ' O ' ' HA ' ' A' ' 163' ' ' SER . 15.7 m -155.05 146.55 13.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.241 -0.436 . . . . 74.24 111.017 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.463 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.89 117.91 22.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.735 0.302 . . . . 75.2 110.891 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.431 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 22.3 p -152.48 166.63 31.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 73.43 111.13 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.434 ' HB3' ' CD1' ' A' ' 149' ' ' ILE . 19.1 m95 -101.92 164.22 11.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.056 -0.52 . . . . 73.31 110.239 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.401 ' CD1' ' OD1' ' A' ' 148' ' ' ASN . 28.6 p90 -160.38 135.16 7.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.072 0.463 . . . . 75.04 111.867 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 216' ' ' PHE . 2.9 m -124.74 109.52 13.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.707 -0.679 . . . . 74.41 110.248 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.631 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.55 144.98 17.55 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.613 -0.803 . . . . 51.4 113.414 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.79 149.51 29.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.863 0.363 . . . . 75.54 110.825 179.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 22.7 mt -88.05 -176.37 5.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 74.12 110.845 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -55.87 -43.58 77.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.356 -0.383 . . . . 75.2 110.899 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.07 -16.78 54.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.945 -0.57 . . . . 73.32 111.161 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 107.31 25.86 5.91 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.724 -0.751 . . . . 75.34 112.589 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.5 m -82.06 112.72 19.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.776 0.322 . . . . 73.42 110.867 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.9 t -66.41 126.78 26.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 62.54 111.171 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.434 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 38.7 p90 -114.36 -28.29 7.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.223 -0.444 . . . . 74.13 111.171 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . 0.423 ' HB2' ' CE1' ' A' ' 145' ' ' PHE . 51.6 m-20 -156.24 111.43 2.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.384 -0.371 . . . . 71.14 110.888 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 61.6 m -142.84 108.88 5.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 73.42 111.096 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . 0.401 ' OD1' ' CD1' ' A' ' 135' ' ' TYR . 20.0 p-10 -102.76 25.6 9.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.428 . . . . 75.35 110.909 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.434 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 9.0 mm -82.03 93.44 2.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.342 -0.39 . . . . 71.22 110.83 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.8 -171.97 2.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 74.24 110.849 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.81 165.97 2.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 74.41 110.971 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.65 162.2 27.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 64.23 110.924 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.02 -36.98 29.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 64.52 111.092 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -60.01 -33.19 71.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 75.22 110.904 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.6 tttp -86.12 -63.14 1.37 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.009 0.433 . . . . 75.45 110.946 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 29.1 tttt -120.88 149.67 42.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.853 -0.612 . . . . 75.22 110.884 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.87 31.35 3.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 74.31 110.911 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -119.51 44.23 2.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 74.33 110.878 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -155.43 128.28 8.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 74.53 111.097 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 15.4 mttp -146.4 147.7 31.82 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.901 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.95 158.2 57.51 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.6 2.2 . . . . 73.22 112.301 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 1.6 tt -76.43 123.6 26.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 74.13 110.451 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.617 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.3 122.35 42.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.951 0.405 . . . . 74.22 111.411 -179.851 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . 0.405 ' CE2' HG21 ' A' ' 171' ' ' VAL . 6.5 p90 -150.98 143.41 24.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 75.04 110.508 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -82.25 141.64 32.79 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.079 0.466 . . . . 74.14 111.226 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.4 m -87.57 149.15 4.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.779 -0.646 . . . . 63.52 111.167 -179.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.74 24.8 75.43 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.857 -0.687 . . . . 51.52 112.456 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . 0.444 ' O ' ' CG2' ' A' ' 168' ' ' VAL . 8.4 p -131.69 40.93 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.846 0.355 . . . . 74.53 111.103 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 40.6 34.18 0.68 Allowed Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.996 -0.621 . . . . 71.54 112.942 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.24 -34.26 32.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.053 0.454 . . . . 74.31 110.411 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . 0.405 HG21 ' CE2' ' A' ' 164' ' ' PHE . 1.8 m -127.34 179.72 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.799 -0.637 . . . . 72.03 110.83 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.524 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 4.1 pt -58.72 163.84 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.442 -0.344 . . . . 74.51 111.091 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -71.13 -29.21 64.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 72.11 111.197 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.12 -38.09 41.06 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.671 -0.776 . . . . 73.43 112.279 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.524 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.2 t90 -75.22 -32.65 61.21 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.851 0.357 . . . . 75.52 110.996 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -61.94 -43.95 97.79 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 63.33 110.524 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -68.35 -30.82 69.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.903 -0.59 . . . . 74.31 110.751 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -78.0 -61.97 1.83 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.202 -0.454 . . . . 65.23 111.379 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.472 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 6.7 mt -56.07 -31.71 63.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.043 -0.526 . . . . 75.33 111.102 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 35.0 tp -59.49 -32.63 70.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.375 -0.375 . . . . 74.22 111.036 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 12.8 t -92.75 -0.65 57.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.327 -0.397 . . . . 74.13 111.479 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.26 152.12 41.13 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.698 0.285 . . . . 62.54 110.871 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.48 162.61 15.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.296 -0.411 . . . . 74.3 111.107 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -61.38 119.42 8.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.924 -0.58 . . . . 74.21 111.144 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 76.03 17.79 79.82 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.99 -0.624 . . . . 73.32 113.042 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -96.72 145.99 25.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.873 0.368 . . . . 71.41 111.105 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt -117.33 136.88 52.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 73.43 110.01 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -149.77 176.12 10.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.033 0.444 . . . . 73.03 111.808 -179.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.11 136.27 36.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.691 -0.686 . . . . 75.41 109.572 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.443 ' CD2' ' CE1' ' A' ' 216' ' ' PHE . 1.4 pt? -140.25 140.42 35.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.141 0.496 . . . . 74.04 112.217 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.74 106.02 12.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.609 -0.723 . . . . 62.42 110.034 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.434 HD13 ' CZ ' ' A' ' 216' ' ' PHE . 4.2 mt -96.52 148.36 5.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.999 0.428 . . . . 60.12 111.582 -179.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.421 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.6 OUTLIER -81.69 167.51 30.76 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.765 -0.652 . . . . 71.13 110.477 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . 0.421 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 18.1 Cg_endo -60.1 -39.84 66.05 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.462 2.108 . . . . 74.33 112.222 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.12 -22.72 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.172 -0.467 . . . . 70.13 111.449 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . 0.426 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 8.9 m0 -118.03 37.01 4.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.687 0.28 . . . . 72.32 111.399 -179.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -155.43 -84.56 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.414 -0.357 . . . . 74.01 111.362 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.428 ' CE2' HG13 ' A' ' 208' ' ' ILE . 41.4 m-85 -106.0 -27.95 10.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.905 0.384 . . . . 75.21 110.828 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 107.28 178.9 22.55 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.846 -0.692 . . . . 71.33 112.836 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -59.61 -36.22 75.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.826 0.346 . . . . 74.44 110.892 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.6 -50.03 75.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 73.53 110.658 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.3 -153.38 17.25 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.86 -0.686 . . . . 70.05 112.595 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . 0.425 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 2.0 tm0? -152.15 84.26 4.9 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.837 0.351 . . . . 72.51 110.515 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -49.99 -44.43 37.34 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.762 2.308 . . . . 74.43 112.783 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.72 -42.12 71.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 65.24 111.012 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -96.43 27.37 3.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.031 -0.531 . . . . 61.24 111.29 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt 49.19 30.65 3.15 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.889 0.376 . . . . 61.33 111.057 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . 0.428 HG13 ' CE2' ' A' ' 198' ' ' TYR . 20.8 mm -94.8 111.75 55.49 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.098 -0.501 . . . . 73.43 111.188 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -69.95 171.04 15.4 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.405 2.07 . . . . 61.41 112.201 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.79 120.95 8.33 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.512 2.141 . . . . 74.24 112.228 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 63.4 70.38 0.53 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.173 -0.467 . . . . 72.3 110.859 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -122.42 154.7 37.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.183 -0.462 . . . . 72.42 111.336 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.42 149.43 22.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.019 -0.537 . . . . 71.53 110.448 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.422 HD13 ' CD2' ' A' ' 198' ' ' TYR . 9.0 mt -131.5 109.72 10.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.857 0.361 . . . . 75.22 111.313 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 1.4 m -110.11 140.49 44.13 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.057 -0.519 . . . . 74.32 110.779 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.631 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 23.2 p90 -155.92 -179.67 8.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.077 0.465 . . . . 75.14 111.374 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -132.89 136.61 46.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.72 -0.673 . . . . 73.43 110.256 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.8 t -120.99 150.31 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.018 0.437 . . . . 74.14 111.792 -178.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -136.23 108.51 7.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.809 -0.632 . . . . 74.02 110.27 179.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . 0.431 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 2.2 tt -70.05 129.55 39.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.332 -0.394 . . . . 64.1 110.91 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 29.6 t -105.99 -31.7 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.169 -0.469 . . . . 74.25 111.483 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -170.3 161.14 8.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.93 0.395 . . . . 74.31 111.219 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 38.4 mt -140.85 110.21 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.053 -0.521 . . . . 70.35 111.003 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 70.31 110.875 179.989 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.814 0.34 . . . . 74.34 111.233 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -133.17 71.4 1.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 64.05 111.111 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -175.58 73.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 73.32 111.088 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -94.97 174.27 7.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 62.11 111.126 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 31.4 t -60.08 110.13 2.58 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.487 . . . . 72.44 110.94 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -82.9 153.64 14.86 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.637 2.224 . . . . 71.51 112.607 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.402 ' NE2' ' CD1' ' A' ' 149' ' ' ILE . 3.0 tp60 -86.38 152.84 22.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 65.02 110.825 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.75 127.03 28.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 73.33 111.134 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -95.58 -31.43 13.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 62.5 110.892 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.452 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 3.0 m-90 -114.23 173.62 6.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.046 -0.525 . . . . 74.12 110.732 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 m -115.55 152.3 33.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.044 -0.526 . . . . 53.22 110.708 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.401 ' CG1' ' HD2' ' A' ' 16' ' ' ARG . 49.1 t -56.24 -34.01 38.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 71.42 110.691 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -73.34 -25.28 60.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.968 -0.56 . . . . 74.44 111.147 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -82.01 -56.55 3.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.821 0.343 . . . . 71.43 110.942 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 mt -49.49 -64.64 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 73.41 111.17 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.401 ' HD2' ' CG1' ' A' ' 12' ' ' VAL . 34.6 mtp85 -54.11 -25.0 19.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 72.31 111.229 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.96 176.62 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.0 0.429 . . . . 71.53 111.293 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -110.34 17.01 21.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.878 -0.601 . . . . 75.1 111.175 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -112.7 -23.45 10.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.554 -0.294 . . . . 73.32 111.222 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.452 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 10.2 tt -90.07 114.03 59.38 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.509 -0.314 . . . . 72.33 110.99 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -57.92 125.3 18.18 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.493 2.129 . . . . 74.34 112.303 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -24.19 67.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 74.0 111.245 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.5 mmtt -52.69 -35.16 54.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.397 . . . . 73.45 111.37 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.91 -56.59 4.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.283 -0.417 . . . . 73.15 111.109 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.425 HD11 HG22 ' A' ' 25' ' ' ILE . 40.4 mt -44.79 -32.86 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.896 -0.593 . . . . 75.12 111.474 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 9.4 mt -75.19 -41.72 44.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.964 0.412 . . . . 73.52 110.907 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -71.55 -25.02 62.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.874 -0.603 . . . . 74.42 111.116 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -70.03 -44.71 68.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.042 0.448 . . . . 62.12 110.761 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.7 mt -72.17 -21.42 61.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.728 -0.669 . . . . 73.32 111.101 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -83.87 -25.78 29.98 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.356 -0.384 . . . . 74.24 111.066 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.424 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -100.97 -1.01 35.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.422 -0.354 . . . . 70.52 111.512 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.424 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.9 m-70 -131.95 -6.47 3.53 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.697 0.258 . . . . 61.1 111.697 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.87 164.43 13.07 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.735 -0.745 . . . . 72.53 112.357 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 54.5 p -91.53 147.94 22.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.584 0.23 . . . . 72.21 110.553 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -48.16 -57.03 6.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.798 0.332 . . . . 72.22 110.991 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.9 m -48.67 -50.03 34.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.083 0.468 . . . . 74.51 110.574 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.479 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 36.5 t80 -53.6 -48.76 68.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.695 -0.684 . . . . 61.4 110.404 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 15.8 mt -65.01 -40.46 94.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.936 -0.575 . . . . 72.14 110.719 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.428 ' CB ' HD22 ' A' ' 44' ' ' LEU . . . -47.17 -47.68 23.89 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.046 0.45 . . . . 75.53 111.098 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -58.09 -26.14 62.2 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.72 -0.673 . . . . 64.4 110.842 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.445 ' O ' ' CG ' ' A' ' 42' ' ' LYS . 52.5 m-70 -112.4 10.57 19.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.265 -0.425 . . . . 74.1 111.239 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.445 ' CG ' ' O ' ' A' ' 41' ' ' HIS . 6.0 ptpt 49.18 35.28 7.08 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.954 0.406 . . . . 63.33 110.995 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 19.0 mt -93.51 -20.44 20.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.959 -0.564 . . . . 72.35 111.574 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.428 HD22 ' CB ' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -79.32 159.26 27.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.026 0.441 . . . . 71.32 111.147 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.56 -120.53 4.97 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 115.775 -0.648 . . . . 60.0 112.482 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -116.37 116.12 27.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.826 0.346 . . . . 74.31 110.878 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mp -45.83 -55.57 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.164 -0.471 . . . . 73.23 111.407 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.3 ptpt -46.95 -36.85 8.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.855 -0.611 . . . . 71.42 110.988 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -85.76 -25.47 26.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.939 -0.573 . . . . 72.22 111.067 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 28.3 t -83.09 -25.92 7.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.365 -0.379 . . . . 74.13 111.403 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.11 -16.29 63.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.426 -0.352 . . . . 74.14 111.474 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.32 -34.3 12.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.808 0.337 . . . . 62.41 110.895 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.4 t -86.95 -30.14 21.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.199 -0.455 . . . . 72.03 111.038 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.13 126.64 40.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 61.32 111.142 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -82.0 177.04 9.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 65.01 110.683 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -58.24 9.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.91 0.386 . . . . 75.44 110.541 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.17 -27.32 68.99 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.055 -0.52 . . . . 64.04 110.582 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.59 -40.61 95.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.067 -0.515 . . . . 70.41 110.399 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 20.3 mt -76.59 -31.12 57.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.743 -0.662 . . . . 75.42 110.936 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.7 t -77.75 -42.73 29.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.995 0.426 . . . . 74.01 110.68 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 53.6 m -60.51 -35.46 76.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.885 -0.598 . . . . 74.31 110.398 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.54 -22.06 44.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.981 -0.554 . . . . 61.4 110.823 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -83.69 -22.94 31.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.066 -0.516 . . . . 75.52 110.837 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -85.73 -53.74 4.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.17 0.509 . . . . 73.4 110.809 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.479 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 1.6 p-80 -59.97 -24.14 64.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.86 -0.609 . . . . 72.55 110.788 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.455 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 0.6 OUTLIER -44.93 -45.99 10.74 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.016 0.436 . . . . 73.01 110.521 179.641 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -79.28 -38.61 34.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.566 -0.743 . . . . 74.33 109.929 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -64.18 -16.24 61.52 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.739 -0.664 . . . . 70.01 111.246 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.86 -11.99 10.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.349 -0.387 . . . . 71.22 111.269 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 51.91 34.63 13.94 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.832 0.348 . . . . 74.35 110.987 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.455 ' CB ' ' CD1' ' A' ' 37' ' ' PHE . 91.6 mtt180 -98.4 46.45 1.0 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 74.23 110.91 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.415 ' CZ ' HD22 ' A' ' 66' ' ' LEU . 82.1 m-85 -71.15 -178.59 2.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.077 -0.511 . . . . 75.54 110.784 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.8 tttp -73.94 141.33 45.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.303 -0.408 . . . . 73.41 110.824 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.41 ' O ' ' N ' ' A' ' 76' ' ' GLU . . . -153.7 142.83 9.5 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.671 -0.776 . . . . 71.14 112.501 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 69.9 p 52.26 -87.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.607 0.242 . . . . 74.23 111.426 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 74' ' ' GLY . 1.6 mm-40 63.91 -79.98 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.793 0.33 . . . . 71.5 110.976 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.2 m -148.63 -78.09 0.15 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.183 -0.462 . . . . 64.53 110.962 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 28.7 mt 69.31 -67.37 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.088 -0.505 . . . . 73.21 111.203 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.1 t -106.14 137.3 44.31 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.957 -0.565 . . . . 75.1 110.912 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.6 mtmp? -161.58 97.71 1.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 75.34 110.897 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.2 m -107.52 174.27 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.458 . . . . 75.22 111.146 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 36.4 p -104.26 177.02 4.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 74.14 110.946 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -147.95 153.81 39.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 74.34 110.895 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -107.26 31.52 5.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.166 -0.47 . . . . 64.4 110.919 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t 59.95 109.53 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 70.02 111.125 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.4 tttm -161.32 -61.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 72.44 110.892 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -146.47 153.76 40.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 73.03 110.908 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.5 t -88.13 96.55 5.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.177 -0.465 . . . . 74.3 111.076 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.6 mtmt -92.86 89.47 6.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 74.23 110.882 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 17.4 mt -101.54 -31.65 10.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 63.33 110.865 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -118.45 116.87 27.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 73.42 110.91 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -91.91 146.87 23.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.19 -0.459 . . . . 73.51 110.954 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -105.75 -33.01 8.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.445 . . . . 70.54 110.93 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -148.78 148.44 27.75 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 71.15 110.873 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.69 118.33 5.59 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.569 2.179 . . . . 73.43 112.282 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 14.9 tttp -112.11 -35.36 5.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 73.21 110.921 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -156.83 144.0 18.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.11 -0.496 . . . . 75.22 110.898 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.09 -68.89 0.21 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 65.0 110.942 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.95 -38.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.942 -0.572 . . . . 75.52 110.916 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 59.88 99.81 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.13 -0.487 . . . . 74.34 110.927 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -102.57 -29.98 11.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 74.32 111.009 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -99.22 166.89 11.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 75.43 110.907 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -169.16 115.35 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.154 -0.475 . . . . 64.24 110.85 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 tp -60.17 154.83 18.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 74.42 110.937 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -174.86 -40.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 75.12 110.929 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -99.35 -31.45 11.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.071 -0.513 . . . . 75.42 110.914 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.67 64.28 0.85 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.716 -0.754 . . . . 75.23 112.527 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.19 161.09 47.29 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.581 2.187 . . . . 71.14 112.29 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.407 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 41.6 Cg_exo -56.89 -162.24 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.619 2.213 . . . . 75.43 112.292 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -97.67 37.4 1.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.469 . . . . 74.32 110.949 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.407 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 11.9 p90 -167.29 151.68 6.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 71.14 110.864 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 26.0 m -113.74 129.94 56.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 71.25 110.296 179.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.93 144.14 51.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.973 0.416 . . . . 74.31 111.374 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -139.94 120.86 14.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.919 -0.582 . . . . 72.44 110.461 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 10.0 p -76.41 106.26 6.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.917 0.389 . . . . 64.42 111.191 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.6 mp -75.74 -75.38 0.18 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 74.45 110.87 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -96.97 107.94 20.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.154 -0.476 . . . . 74.21 110.9 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -58.68 126.29 27.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.166 -0.47 . . . . 73.32 110.937 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -86.26 -174.29 49.49 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.654 -0.784 . . . . 72.32 112.224 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -40.46 -40.95 1.32 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.828 0.347 . . . . 73.23 111.544 -179.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.8 tttp 73.4 43.15 0.38 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.461 . . . . 74.53 110.595 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.0 m -157.3 -45.41 0.07 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.899 -0.592 . . . . 73.31 110.55 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.14 97.55 10.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.07 -0.514 . . . . 72.31 110.692 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -111.11 156.12 41.47 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.078 -0.51 . . . . 74.31 110.834 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -68.61 125.6 12.96 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.514 2.143 . . . . 74.41 112.342 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.98 152.16 20.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 75.13 110.937 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -58.84 116.1 3.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 75.1 110.9 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 105.05 -21.92 34.61 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.705 -0.759 . . . . 73.42 112.669 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.3 138.99 31.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.845 0.355 . . . . 74.41 110.828 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.515 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 24.4 m -69.59 171.95 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 73.25 111.235 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.645 ' O ' ' HA ' ' A' ' 163' ' ' SER . 16.4 m -156.87 145.39 11.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.71 -0.677 . . . . 74.52 110.66 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.439 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.72 117.61 22.25 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.986 -0.285 . . . . 73.34 110.72 179.705 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.407 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.3 p -153.67 171.44 18.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.004 0.43 . . . . 70.03 111.15 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.418 ' HB3' ' CD1' ' A' ' 149' ' ' ILE . 10.0 m95 -107.67 161.85 14.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.8 -0.637 . . . . 75.33 110.107 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.465 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 45.1 p90 -161.74 137.19 7.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.07 0.462 . . . . 75.34 111.917 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 5.4 m -126.72 112.38 15.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.661 -0.699 . . . . 73.35 110.646 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.581 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.67 142.57 16.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.603 -0.808 . . . . 61.45 112.976 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.58 143.87 28.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.8 0.333 . . . . 75.03 110.762 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 14.2 mt -83.22 -177.63 6.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 73.44 110.977 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -59.29 -43.22 92.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 72.04 110.906 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.81 -7.78 54.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.045 -0.525 . . . . 74.24 111.327 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 92.42 24.12 24.82 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.695 -0.764 . . . . 75.12 112.619 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.41 113.24 25.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.345 . . . . 71.21 110.777 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 8.3 p -63.64 130.95 29.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 74.11 111.162 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.417 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 36.2 p90 -108.95 -28.2 9.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.001 -0.545 . . . . 74.3 110.842 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -168.19 122.23 0.92 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.176 -0.465 . . . . 72.11 110.768 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 10.4 t -142.87 124.31 14.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.358 -0.383 . . . . 71.1 111.192 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . 0.465 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 29.9 t30 -91.86 40.85 1.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.082 -0.508 . . . . 72.1 110.804 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.418 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 6.7 mm -112.68 99.41 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.123 -0.489 . . . . 64.5 110.928 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -96.14 -78.86 0.45 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.306 -0.406 . . . . 74.51 110.979 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 2.8 p -146.53 166.05 27.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.246 -0.433 . . . . 70.53 110.91 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.4 m -74.09 151.63 40.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 74.55 110.863 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.03 -31.25 34.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.149 -0.478 . . . . 62.13 111.166 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -70.23 -34.18 72.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 75.4 111.01 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.14 -35.79 41.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 71.44 110.889 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.1 mmmt -153.3 155.49 36.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 75.33 110.905 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -98.65 30.4 3.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.2 -0.454 . . . . 70.22 110.924 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -114.72 40.47 2.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 62.2 110.81 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.16 133.25 9.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 71.31 111.097 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -146.38 134.38 10.6 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.255 -0.43 . . . . 74.45 110.837 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . 0.409 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 49.6 Cg_exo -55.37 156.4 17.41 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.446 2.097 . . . . 72.31 112.33 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 4.0 tt -74.67 122.96 24.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 74.42 110.429 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.645 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -100.26 121.2 41.09 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.03 0.443 . . . . 75.3 111.48 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . 0.443 ' CE1' ' CG2' ' A' ' 131' ' ' VAL . 7.3 p90 -149.71 140.97 23.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.88 -0.6 . . . . 75.22 110.571 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 72.3 mttt -77.48 136.7 38.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.038 0.447 . . . . 73.42 111.111 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.1 m -87.65 149.31 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.822 -0.627 . . . . 74.41 111.084 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.87 22.83 78.34 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.786 -0.721 . . . . 75.53 112.565 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 28.9 m -131.06 42.18 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.88 0.371 . . . . 73.43 111.044 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.25 38.57 6.6 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 121.137 -0.554 . . . . 74.54 113.062 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.34 -47.03 11.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.933 0.397 . . . . 74.12 110.852 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . 0.41 HG11 ' CE3' ' A' ' 175' ' ' TRP . 1.9 m -116.91 -179.94 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.943 -0.571 . . . . 75.21 110.913 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.521 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.88 161.44 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.414 -0.357 . . . . 74.42 111.297 -179.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 15.8 ttt85 -69.57 -26.68 64.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.195 -0.457 . . . . 73.13 110.998 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.11 -37.86 36.51 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.772 -0.727 . . . . 64.43 112.029 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.521 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 1.8 t90 -77.46 -32.9 54.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.024 0.44 . . . . 75.01 111.056 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.63 -35.47 80.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.802 -0.635 . . . . 73.43 110.479 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -75.97 -29.17 58.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 71.01 110.634 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -81.92 -54.44 5.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 65.14 111.125 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.435 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 14.5 mt -62.26 -18.92 62.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.883 -0.599 . . . . 75.54 111.186 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.8 tp -56.46 -23.91 42.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.344 -0.389 . . . . 73.41 111.452 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 16.5 p -112.94 18.13 18.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.596 -0.275 . . . . 71.15 111.585 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' MET . . . . . 0.4 ' HG3' HD23 ' A' ' 179' ' ' LEU . 7.4 mmm -77.06 95.18 4.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.831 0.348 . . . . 71.3 111.123 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.3 168.18 7.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 73.12 111.064 -179.699 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -62.81 113.23 2.92 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.873 -0.603 . . . . 63.32 110.949 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 84.98 0.96 88.99 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 120.854 -0.689 . . . . 70.42 112.91 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.58 137.94 44.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.923 0.392 . . . . 74.44 111.503 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.75 137.41 53.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.976 -0.556 . . . . 74.5 109.766 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -141.83 168.59 19.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.259 0.552 . . . . 72.44 112.132 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -137.78 101.01 4.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.391 -0.822 . . . . 63.15 109.766 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -123.66 149.48 45.39 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.067 0.461 . . . . 71.1 112.011 -178.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -119.37 117.1 27.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.605 -0.725 . . . . 71.12 110.247 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.424 HD12 ' CZ ' ' A' ' 216' ' ' PHE . 3.3 mp -98.33 137.85 24.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.969 0.414 . . . . 71.03 111.516 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.404 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.4 mt-10 -71.36 167.56 28.94 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.866 -0.607 . . . . 75.4 110.499 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . 0.404 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 20.8 Cg_endo -60.94 -41.65 43.21 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.391 2.061 . . . . 75.33 112.261 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -53.11 -26.82 17.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 71.42 111.405 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . . . . . . . . . 17.8 m0 -116.1 37.01 3.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.494 -0.321 . . . . 65.23 111.178 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -157.84 -82.3 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.348 -0.387 . . . . 72.41 111.641 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.447 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 14.2 m-85 -106.25 -32.9 7.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.907 0.384 . . . . 75.23 110.949 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 106.49 172.55 23.02 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.84 -0.695 . . . . 72.45 112.715 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 33.7 mtmt -61.59 -30.41 70.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.832 0.348 . . . . 73.14 110.902 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -56.16 -52.25 65.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 75.34 110.8 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 109.25 158.33 18.26 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.818 -0.706 . . . . 73.11 112.444 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . 0.419 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.9 OUTLIER -104.76 84.84 1.04 Allowed Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 120.771 0.32 . . . . 71.31 110.758 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.01 -20.15 57.43 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.591 2.194 . . . . 71.05 112.412 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -58.56 -41.89 86.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.368 -0.378 . . . . 65.32 110.891 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.5 28.38 8.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.102 -0.499 . . . . 75.33 111.26 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 7.9 tttt 58.43 54.42 5.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.937 0.399 . . . . 75.23 110.95 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . 0.436 HD12 ' CE2' ' A' ' 198' ' ' TYR . 33.9 mt -115.69 111.77 43.41 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 72.45 111.086 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.1 169.26 2.92 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.568 2.179 . . . . 71.11 112.398 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.27 128.01 12.49 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.636 2.224 . . . . 74.42 112.24 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 65.81 74.22 0.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.31 -0.404 . . . . 73.13 110.758 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.57 153.5 43.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.434 . . . . 74.01 111.365 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.12 139.16 30.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.011 -0.54 . . . . 75.22 110.367 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.447 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 5.8 mt -120.45 109.48 15.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.922 0.391 . . . . 73.1 111.441 -179.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 2.6 m -107.48 141.1 39.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.018 -0.537 . . . . 75.32 110.662 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.581 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 5.8 p90 -159.64 -177.7 6.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 74.52 111.177 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -138.71 141.86 38.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.899 -0.591 . . . . 74.34 110.552 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 23.5 t -121.55 152.43 25.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 70.42 112.01 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -135.5 106.0 6.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.707 -0.679 . . . . 75.02 110.356 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . 0.407 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.67 126.79 30.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.362 -0.381 . . . . 74.25 110.658 -179.774 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 21.2 t -108.06 -30.25 2.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.263 -0.426 . . . . 71.13 111.654 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -169.96 160.05 8.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.915 0.388 . . . . 63.53 111.183 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 3.5 mp -141.85 111.27 2.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.971 -0.559 . . . . 73.14 110.955 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.327 -0.397 . . . . 72.11 110.958 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mpt? . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.849 0.357 . . . . 74.34 111.207 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.56 156.24 25.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.179 -0.464 . . . . 71.11 111.028 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.449 ' O ' ' CB ' ' A' ' 4' ' ' ALA . . . -60.84 -168.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.183 -0.462 . . . . 73.21 111.113 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.449 ' CB ' ' O ' ' A' ' 3' ' ' ALA . . . 161.73 87.21 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.135 -0.484 . . . . 73.35 110.948 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 43.8 t -87.17 111.1 38.6 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.595 -0.275 . . . . 71.13 110.966 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.425 ' HG3' ' CG ' ' A' ' 32' ' ' HIS . 72.4 Cg_endo -77.62 136.99 15.89 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.638 2.226 . . . . 75.11 112.435 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 19.6 mm-40 -80.25 155.52 27.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 71.14 110.902 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.09 112.81 0.78 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.137 -0.483 . . . . 75.02 111.221 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.44 -14.78 32.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 73.22 111.414 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.447 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 1.3 m-90 -137.98 173.79 11.26 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.967 0.413 . . . . 74.3 110.814 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.2 m -115.43 149.83 37.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.988 -0.551 . . . . 74.31 110.713 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t -56.09 -31.33 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.926 0.393 . . . . 73.12 110.712 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -76.02 -25.96 56.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.871 -0.604 . . . . 70.11 111.004 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -82.11 -57.92 3.18 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.834 0.349 . . . . 71.43 110.813 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 mt -49.57 -63.09 1.21 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.222 -0.445 . . . . 73.2 110.948 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 25.4 mtt180 -53.99 -23.79 14.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.071 -0.513 . . . . 74.51 111.243 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.18 176.76 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.964 0.412 . . . . 75.24 111.121 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -110.34 16.8 21.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.95 -0.568 . . . . 75.31 111.158 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.41 -26.09 12.09 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.512 -0.313 . . . . 74.44 111.144 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.447 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 6.3 tt -91.97 111.55 50.45 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.39 -0.368 . . . . 70.41 111.016 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -55.88 130.01 38.04 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.378 2.052 . . . . 64.11 112.184 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.31 -24.09 67.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 75.24 111.127 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.5 mttt -49.78 -43.19 48.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.31 -0.404 . . . . 71.2 111.588 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -73.86 -54.79 7.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.936 0.398 . . . . 75.12 111.07 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.44 HG22 HD11 ' A' ' 25' ' ' ILE . 25.7 mt -45.36 -33.86 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.846 -0.615 . . . . 72.22 111.443 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 6.7 mt -76.79 -39.85 31.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.284 -0.416 . . . . 73.24 110.995 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.1 mttt -72.86 -25.61 61.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.036 -0.529 . . . . 73.44 111.009 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -69.74 -45.78 67.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.121 0.486 . . . . 74.14 110.719 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 mt -70.17 -25.58 63.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.608 -0.724 . . . . 75.15 111.115 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -74.38 -26.74 60.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.355 -0.384 . . . . 64.31 110.893 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.421 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 8.6 pt-20 -90.81 -39.05 12.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.346 -0.388 . . . . 73.23 110.706 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.425 ' CG ' ' HG3' ' A' ' 6' ' ' PRO . 35.8 m170 -98.54 16.63 21.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 72.21 110.964 179.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.61 153.32 23.02 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.829 -0.7 . . . . 62.42 112.571 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.57 154.47 19.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.651 0.263 . . . . 70.24 110.515 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -49.14 -56.97 7.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.76 0.315 . . . . 74.42 111.1 -179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -48.18 -50.23 29.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.033 0.444 . . . . 62.3 110.896 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.441 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 13.4 t80 -54.04 -47.73 71.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.795 -0.639 . . . . 72.11 110.493 179.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.42 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 13.3 mt -66.02 -41.39 91.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.062 -0.517 . . . . 71.23 110.777 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.428 ' CB ' HD21 ' A' ' 44' ' ' LEU . . . -48.07 -42.04 27.67 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.076 0.465 . . . . 73.4 110.827 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -49.55 -50.11 43.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.621 -0.718 . . . . 74.4 110.926 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -101.49 15.3 29.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.076 -0.511 . . . . 74.32 111.291 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 36.1 mttt 54.98 39.92 31.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.884 0.373 . . . . 73.53 111.05 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 17.0 mt -89.53 -22.18 22.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 73.23 111.487 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.428 HD21 ' CB ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.42 156.01 28.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.106 0.479 . . . . 74.23 111.171 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.72 -120.98 4.87 Favored Glycine 0 N--CA 1.451 -0.301 0 CA-C-N 115.641 -0.709 . . . . 74.12 112.379 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -116.39 115.2 25.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.771 0.32 . . . . 72.21 110.948 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mp -45.18 -58.37 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.186 -0.461 . . . . 74.32 111.397 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 mmtt -45.57 -36.96 5.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.782 -0.644 . . . . 75.33 111.049 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -85.77 -26.54 25.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.939 -0.573 . . . . 74.31 110.993 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 19.3 t -80.83 -26.03 10.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 74.02 111.417 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.64 -15.7 63.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.364 -0.38 . . . . 72.21 111.394 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.3 mtpt -95.17 -35.16 11.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.411 -0.359 . . . . 73.43 110.931 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 m -86.03 -22.42 27.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.173 -0.467 . . . . 64.42 111.318 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -107.95 136.76 47.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.467 -0.333 . . . . 72.22 111.19 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -93.27 -178.02 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 74.43 110.768 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -58.1 10.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.825 0.345 . . . . 73.43 110.981 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.32 -27.3 65.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.119 -0.491 . . . . 72.35 110.67 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -45.48 93.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.007 -0.542 . . . . 71.14 110.702 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 23.6 mt -73.31 -30.49 63.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.625 -0.716 . . . . 70.55 111.415 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 16.0 t -80.51 -43.67 21.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.989 0.424 . . . . 75.12 110.853 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.1 m -58.44 -35.87 72.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.881 -0.6 . . . . 73.43 110.583 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.71 -21.84 34.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.084 -0.507 . . . . 71.24 111.031 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -83.28 -22.96 32.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.298 -0.41 . . . . 73.22 111.162 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -83.07 -54.03 5.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.885 0.374 . . . . 74.13 111.43 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.433 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 4.4 p-80 -61.16 -34.08 74.45 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.495 . . . . 65.13 111.283 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.441 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.2 tt -46.42 -40.47 12.24 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.898 0.38 . . . . 74.03 111.201 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -78.98 -36.09 41.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.009 -0.541 . . . . 74.42 110.691 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -67.25 -39.85 86.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.058 -0.519 . . . . 72.24 110.873 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 71.5 p -94.87 -3.1 49.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.025 -0.534 . . . . 63.1 111.434 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 48.96 39.66 15.1 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.757 0.313 . . . . 73.32 111.38 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -93.52 43.66 1.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.384 -0.371 . . . . 73.34 111.034 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.432 ' CD2' HD22 ' A' ' 66' ' ' LEU . 88.5 m-85 -66.26 177.09 1.54 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.317 -0.401 . . . . 62.52 110.82 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.2 tttt -66.57 153.06 43.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.262 -0.426 . . . . 74.53 110.985 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' A' ' 76' ' ' GLU . . . -133.32 74.98 0.43 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.77 -0.728 . . . . 74.24 112.529 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.4 p 51.59 -87.77 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.612 0.244 . . . . 71.15 111.367 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 74' ' ' GLY . 3.7 mt-10 63.39 143.23 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.82 0.343 . . . . 75.21 110.884 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.6 t -66.58 113.14 4.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 45.44 110.897 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 2.5 pp -157.49 -44.98 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 74.54 111.208 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 92.4 p -105.03 127.62 52.96 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.029 -0.532 . . . . 75.41 110.911 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.3 tttp -134.82 92.47 2.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 74.3 110.919 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.4 t -99.94 99.14 7.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 72.53 111.101 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 50.7 p -161.63 -44.66 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 72.02 110.886 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 66.5 -75.97 0.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.238 -0.437 . . . . 70.2 110.937 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 62.76 147.73 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.018 -0.537 . . . . 71.23 110.933 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.3 t -109.31 159.0 9.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 61.2 111.164 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.6 tttp -59.31 -172.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.272 -0.422 . . . . 75.35 110.95 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -61.18 95.29 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 72.34 110.919 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.0 m -150.62 164.92 2.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 75.32 111.094 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.87 -36.94 11.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 74.52 110.865 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 12.8 mt 58.61 106.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.481 . . . . 71.34 110.956 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -97.23 77.59 2.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 65.31 110.842 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -175.42 160.72 2.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 73.22 110.869 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -94.44 120.65 34.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 75.55 110.876 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.8 mtpm? -112.27 150.15 42.09 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 73.33 110.885 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.1 177.85 5.38 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.533 2.155 . . . . 74.14 112.329 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.42 106.46 16.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.245 -0.434 . . . . 74.32 110.875 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -101.05 151.52 21.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 75.12 110.891 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 7.2 t -175.73 87.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 72.22 110.911 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 mmtm 62.5 -80.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.124 -0.489 . . . . 75.12 111.026 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.5 m -84.69 164.69 18.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.243 -0.435 . . . . 74.21 110.926 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -96.24 76.58 3.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.437 . . . . 74.34 110.951 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 60.08 109.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 72.43 110.891 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 10.0 p -123.93 101.08 7.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 73.33 110.889 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.0 mt 60.4 93.13 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.465 . . . . 73.0 110.926 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -106.93 -29.76 9.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 73.33 110.919 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -58.84 -31.13 68.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 71.21 110.951 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 112.75 95.04 2.18 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.735 -0.745 . . . . 75.21 112.523 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -68.1 157.7 60.68 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.502 2.134 . . . . 73.34 112.304 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -49.36 -71.84 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.564 2.176 . . . . 63.04 112.496 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.441 ' CB ' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -163.86 23.68 0.07 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.461 . . . . 75.25 110.687 179.746 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -166.53 150.52 7.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 74.14 110.858 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.427 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 77.0 m -112.23 133.02 54.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.126 -0.488 . . . . 75.32 110.346 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -130.88 148.32 52.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.953 0.406 . . . . 73.21 111.33 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -149.6 121.75 8.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.934 -0.576 . . . . 72.43 110.742 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 21.5 t -78.86 110.24 14.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.326 -0.397 . . . . 75.22 111.224 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -81.69 -46.62 14.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 74.41 110.926 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -124.32 108.12 11.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.438 . . . . 74.34 111.054 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.6 ttpm? -59.57 141.89 53.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 75.13 110.865 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.499 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -112.86 -156.11 12.35 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.738 -0.744 . . . . 74.32 112.605 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -36.05 -51.72 0.74 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.96 0.409 . . . . 64.52 111.527 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 69.03 33.82 3.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.926 -0.579 . . . . 71.13 110.307 -179.692 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 54.8 m -152.4 -44.61 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.76 -0.655 . . . . 60.43 110.698 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -88.94 91.13 8.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.481 . . . . 75.23 110.732 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -99.5 152.72 37.9 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 74.15 110.826 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -72.96 125.5 10.46 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.551 2.167 . . . . 73.51 112.495 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.4 mmtm -96.36 154.13 17.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.982 -0.554 . . . . 75.05 110.865 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.0 tptm -56.75 119.67 6.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.24 -0.437 . . . . 74.4 110.795 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 100.24 -22.72 38.81 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.626 -0.797 . . . . 72.44 112.366 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -81.54 137.63 35.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.745 0.307 . . . . 70.24 110.69 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.54 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 15.6 m -75.09 175.41 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.198 0.523 . . . . 75.43 111.767 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.598 ' O ' ' HA ' ' A' ' 163' ' ' SER . 22.3 m -157.75 147.0 9.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.342 -0.845 . . . . 74.2 110.557 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.453 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -125.21 117.27 23.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.701 0.286 . . . . 74.41 110.633 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.422 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 32.1 p -154.2 167.25 30.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.87 0.367 . . . . 74.33 111.156 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.436 ' CE3' HG13 ' A' ' 149' ' ' ILE . 62.6 m95 -99.66 160.6 14.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.972 -0.558 . . . . 72.23 110.065 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 33.4 p90 -158.76 135.18 9.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.065 0.459 . . . . 75.23 111.584 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 54.3 m -126.74 111.59 14.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.658 -0.701 . . . . 64.24 110.417 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.545 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.78 142.9 16.35 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.604 -0.808 . . . . 75.31 113.07 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -149.34 138.95 21.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.761 0.315 . . . . 74.04 110.799 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 32.6 mt -72.81 -178.14 2.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.296 -0.411 . . . . 65.21 110.64 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -58.89 -42.59 89.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.987 0.422 . . . . 73.34 110.796 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.27 -7.67 55.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.942 -0.572 . . . . 72.44 111.368 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 94.7 25.77 14.61 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.648 -0.787 . . . . 63.02 112.582 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.27 108.38 18.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.8 0.333 . . . . 73.44 110.837 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 11.2 p -66.31 124.01 20.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.18 -0.463 . . . . 75.53 111.116 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.421 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 44.8 p90 -110.08 -21.28 12.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.155 -0.475 . . . . 73.33 111.095 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -157.02 127.94 6.73 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.857 0.361 . . . . 74.22 110.997 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 75.1 m -142.79 105.28 4.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 74.14 110.862 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -76.07 -6.52 51.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 73.42 111.323 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.476 ' CD1' ' N ' ' A' ' 149' ' ' ILE . 2.4 mp -95.78 114.76 33.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.827 0.346 . . . . 64.14 111.0 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -116.65 -73.94 0.63 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 72.31 110.908 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 61.4 p -113.15 165.96 11.89 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 71.34 110.909 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.3 m -95.12 168.53 10.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 54.43 110.895 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.04 -31.2 34.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.455 . . . . 72.52 111.093 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -31.73 70.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 75.5 110.949 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -78.36 -39.18 40.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 75.41 110.928 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 4.5 tttp -178.33 -177.63 0.58 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.097 -0.501 . . . . 71.25 110.919 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -98.97 34.73 2.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 73.11 110.872 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 45.4 m-20 -100.59 36.75 1.84 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 73.12 110.933 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -155.6 126.46 6.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 75.35 111.131 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.2 tttt -146.64 145.41 23.09 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 64.11 110.676 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.65 158.02 58.01 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.355 2.037 . . . . 73.33 112.239 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -80.04 127.87 32.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.126 -0.488 . . . . 72.12 110.845 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.598 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.8 OUTLIER -105.73 126.83 52.62 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.272 -0.422 . . . . 74.11 111.047 179.801 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 20.8 p90 -151.35 141.45 22.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 72.33 110.951 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 2.4 mtpt -69.62 130.81 43.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.305 -0.407 . . . . 71.43 110.909 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.3 m -87.77 149.32 4.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 63.33 111.057 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 69.04 24.22 75.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.729 -0.748 . . . . 74.21 112.577 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 15.4 m -134.09 46.43 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.915 0.388 . . . . 73.44 111.125 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.29 36.24 2.92 Favored Glycine 0 C--N 1.331 0.302 0 CA-C-N 116.101 -0.499 . . . . 50.4 113.295 179.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.43 -45.72 14.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.858 0.361 . . . . 74.42 111.089 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . 0.414 HG13 ' CE3' ' A' ' 175' ' ' TRP . 0.7 OUTLIER -119.26 -179.64 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.087 -0.506 . . . . 74.4 110.994 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.523 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -58.35 159.33 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.394 -0.367 . . . . 73.54 111.136 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 7.4 ttt85 -68.04 -27.23 66.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.254 -0.43 . . . . 73.13 111.191 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.3 -36.34 39.91 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.663 -0.78 . . . . 53.32 112.169 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.523 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.2 t90 -78.28 -33.62 49.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.909 0.385 . . . . 72.15 111.109 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -64.42 -38.26 90.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.088 -0.506 . . . . 55.2 110.489 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -73.5 -30.62 63.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.901 -0.59 . . . . 73.02 110.619 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -79.74 -55.96 4.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.496 . . . . 65.51 111.106 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.47 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 5.3 mt -59.69 -28.78 67.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.933 -0.576 . . . . 75.42 110.809 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.4 mt -60.42 -32.02 70.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.425 . . . . 74.32 110.789 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 63.9 p -92.41 2.45 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 73.14 111.407 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.24 150.04 37.09 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.741 0.305 . . . . 65.24 110.769 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.4 165.38 13.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 63.24 111.206 -179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.49 117.62 5.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.951 -0.568 . . . . 73.42 110.8 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.53 66.41 2.25 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.675 -0.774 . . . . 71.31 112.319 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . 0.499 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.8 tt0 -144.51 145.81 32.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.602 0.239 . . . . 73.12 110.389 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -117.55 134.72 54.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.688 0.28 . . . . 74.12 110.332 179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.29 168.0 20.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.113 0.482 . . . . 61.23 111.648 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.56 104.43 5.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.64 -0.709 . . . . 74.03 109.882 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.427 ' HA ' ' O ' ' A' ' 112' ' ' THR . 0.4 OUTLIER -126.52 147.18 49.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.081 0.467 . . . . 74.23 111.832 -179.069 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -117.07 125.17 50.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.689 -0.687 . . . . 72.43 110.438 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.416 HG12 ' CE2' ' A' ' 216' ' ' PHE . 2.4 mm -94.32 152.15 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.881 0.372 . . . . 74.32 111.221 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -87.06 159.11 51.95 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.052 -0.522 . . . . 70.12 110.657 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.37 -44.36 38.74 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.567 2.178 . . . . 71.43 112.228 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -56.34 -39.65 73.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.268 -0.424 . . . . 74.5 111.194 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . 0.441 ' CD2' ' CB ' ' A' ' 110' ' ' LYS . 9.9 m0 -97.37 36.95 1.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.324 -0.398 . . . . 72.23 110.99 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -164.64 -77.52 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.025 -0.534 . . . . 53.33 110.705 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.449 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 22.3 m-85 -102.85 -71.22 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 73.02 110.571 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 135.32 175.87 14.06 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.839 -0.696 . . . . 75.24 112.714 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 19.8 mtpt -58.34 -32.38 68.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.879 0.371 . . . . 74.44 110.884 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 11.1 mttm -59.83 -52.95 63.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 73.44 110.729 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 103.58 176.11 26.04 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.822 -0.704 . . . . 45.2 112.499 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . 0.421 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.4 OUTLIER -117.3 81.75 13.86 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.822 0.344 . . . . 75.11 110.791 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.12 -25.26 44.74 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.669 2.246 . . . . 65.41 112.46 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.25 -42.19 94.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.917 0.389 . . . . 64.12 111.04 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -103.82 29.81 5.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.114 -0.494 . . . . 73.25 111.212 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 39.8 mttt 56.09 28.03 12.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.258 -0.428 . . . . 73.2 111.075 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . 0.42 HD11 ' CE2' ' A' ' 198' ' ' TYR . 40.0 mt -91.38 111.67 50.15 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 73.43 110.992 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -74.0 173.92 13.25 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.491 2.127 . . . . 73.03 112.474 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -51.04 137.91 44.2 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.674 2.249 . . . . 72.24 112.255 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 5.9 p30 42.11 88.81 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.151 -0.477 . . . . 71.53 111.395 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.47 116.27 21.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.319 -0.4 . . . . 55.54 111.398 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 1.6 tptm -65.66 126.58 28.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 72.42 110.378 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.449 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 19.1 mt -104.47 109.52 21.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.342 -0.39 . . . . 72.15 111.44 -179.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 52.4 m -102.45 137.31 40.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 73.41 110.563 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.545 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 5.5 p90 -154.94 175.26 14.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.027 0.442 . . . . 75.25 111.331 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -133.01 136.77 46.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.645 . . . . 74.03 110.523 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.1 t -123.63 150.56 27.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.072 0.463 . . . . 64.32 111.891 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -136.81 111.07 8.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.744 -0.662 . . . . 74.4 110.225 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . 0.422 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 1.9 tt -69.93 129.28 39.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.831 0.348 . . . . 72.22 111.004 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 21.6 t -108.7 -29.32 2.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 64.54 111.421 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -170.66 161.34 7.49 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.91 0.386 . . . . 74.23 111.018 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 46.6 mt -139.79 110.43 4.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 74.15 111.051 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 74.54 110.952 179.966 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 ttp . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.83 0.348 . . . . 73.3 111.228 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.9 143.29 49.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 73.13 111.102 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.98 127.44 11.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.228 -0.442 . . . . 72.21 111.136 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -88.22 174.45 8.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 62.1 111.077 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 43.0 t -60.09 110.37 2.78 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 73.34 111.055 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.434 ' HD2' ' CE2' ' A' ' 72' ' ' PHE . 95.1 Cg_endo -78.72 143.84 19.05 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.667 2.244 . . . . 75.54 112.408 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -81.67 151.34 27.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 64.35 110.774 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.57 113.99 0.95 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 74.23 111.182 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -88.07 -16.34 33.84 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.14 -0.482 . . . . 55.22 111.351 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.417 ' CH2' ' HB3' ' A' ' 24' ' ' ASP . 3.9 m-90 -136.34 173.63 11.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.836 0.35 . . . . 70.34 110.719 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.1 m -115.82 150.33 37.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.069 -0.514 . . . . 72.52 110.617 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t -56.3 -32.06 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.958 0.409 . . . . 74.41 110.772 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -77.01 -24.66 52.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.926 -0.579 . . . . 75.21 111.156 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -82.12 -57.25 3.48 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.851 0.358 . . . . 74.34 110.911 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mt -51.3 -60.31 3.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.253 -0.43 . . . . 74.24 111.012 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 21.7 mtt180 -57.51 -25.43 59.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.031 -0.531 . . . . 74.11 111.33 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.02 173.06 0.49 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.847 0.356 . . . . 72.32 110.983 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -99.78 16.18 24.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.095 -0.502 . . . . 74.12 111.207 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -112.31 -30.35 7.21 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.421 -0.354 . . . . 73.34 110.805 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.405 HD22 ' CD1' ' A' ' 10' ' ' TRP . 2.4 tm? -75.26 114.27 33.78 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 72.35 110.673 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -64.91 123.3 11.42 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.389 2.059 . . . . 71.1 112.488 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -26.52 68.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.04 -0.527 . . . . 75.23 111.254 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.2 ttmt -53.54 -37.02 62.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.877 0.37 . . . . 73.42 111.174 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.417 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 0.1 OUTLIER -74.41 -56.1 5.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 72.2 110.845 179.957 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.481 HD12 HG23 ' A' ' 25' ' ' ILE . 42.5 mt -44.89 -32.09 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.83 -0.623 . . . . 72.54 111.44 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.6 mt -76.66 -40.68 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 61.45 111.038 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -71.42 -24.91 62.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.893 -0.594 . . . . 73.14 111.21 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -72.36 -45.5 59.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.949 0.404 . . . . 75.42 110.886 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mt -68.41 -25.09 64.86 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.859 -0.609 . . . . 73.24 111.053 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -80.95 -24.44 38.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.31 -0.404 . . . . 72.14 111.177 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.419 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -101.26 -7.35 23.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.469 -0.332 . . . . 74.13 111.503 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.419 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.9 m-70 -125.78 -3.13 7.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.7 -0.227 . . . . 74.31 111.606 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.43 161.37 19.91 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.707 -0.758 . . . . 72.54 112.418 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -89.68 149.45 22.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.588 0.233 . . . . 63.15 110.61 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -49.1 -57.0 7.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.801 0.334 . . . . 73.21 111.075 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 14.5 m -47.24 -51.61 18.29 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.217 -0.447 . . . . 74.22 110.852 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.478 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 12.8 t80 -55.19 -44.3 75.19 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.857 -0.61 . . . . 74.44 110.323 179.56 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.417 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 13.4 mt -65.38 -42.4 92.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.015 -0.539 . . . . 73.43 110.665 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.409 ' CB ' HD23 ' A' ' 44' ' ' LEU . . . -46.48 -45.35 18.28 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.223 -0.444 . . . . 73.11 111.171 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.28 -25.74 64.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.857 -0.611 . . . . 74.21 110.859 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 67.0 m-70 -112.69 8.49 19.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.253 -0.43 . . . . 74.33 111.166 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt 54.38 33.7 19.14 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.804 0.335 . . . . 74.11 110.905 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.8 mt -92.39 -24.9 18.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 63.43 111.758 -179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.417 ' N ' ' HB3' ' A' ' 38' ' ' LEU . 0.3 OUTLIER -73.79 156.66 37.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.092 0.472 . . . . 74.21 111.185 -179.568 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.4 -122.75 5.7 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.671 -0.695 . . . . 70.43 112.378 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -116.31 119.48 35.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.787 0.327 . . . . 74.03 110.93 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mp -45.96 -53.22 2.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.224 -0.444 . . . . 75.35 111.337 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -47.93 -38.2 16.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.887 -0.597 . . . . 74.02 110.961 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -85.61 -25.57 26.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 75.53 111.059 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 26.3 t -81.86 -25.83 9.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.343 -0.389 . . . . 73.41 111.396 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.97 -17.13 63.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.384 -0.371 . . . . 73.55 111.438 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.2 pttt -95.19 -35.37 11.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.445 -0.343 . . . . 75.44 110.941 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.4 m -86.2 -23.38 26.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.202 -0.453 . . . . 72.04 111.105 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -101.97 125.9 48.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.373 -0.376 . . . . 75.14 111.161 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.29 175.28 10.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 74.33 110.559 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.1 -58.28 9.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.823 0.344 . . . . 74.12 110.51 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.86 -26.08 68.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.109 -0.496 . . . . 74.33 110.578 179.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.48 -43.21 99.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.114 -0.494 . . . . 74.53 110.341 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 20.8 mt -75.04 -30.11 60.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.631 -0.713 . . . . 72.4 110.998 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 14.0 t -79.14 -43.14 24.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.984 0.421 . . . . 73.32 110.759 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.9 m -60.27 -36.21 77.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.823 -0.626 . . . . 72.44 110.707 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -80.85 -22.31 40.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 75.22 111.0 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -83.76 -22.89 31.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.117 -0.492 . . . . 74.21 110.956 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -84.99 -54.35 4.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 75.34 111.342 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.466 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 2.5 p-80 -61.39 -24.49 66.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.06 -0.518 . . . . 75.45 111.179 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.478 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 3.9 tt -55.39 -39.33 70.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.937 0.399 . . . . 74.03 110.835 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -78.25 -38.82 41.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.025 -0.534 . . . . 71.33 110.705 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -37.46 78.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.013 -0.54 . . . . 74.34 111.002 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 45.4 p -90.02 -9.53 48.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.079 -0.509 . . . . 73.11 111.489 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.25 34.1 13.96 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.764 0.316 . . . . 75.54 111.186 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.5 mtt180 -93.63 45.18 1.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.289 -0.414 . . . . 74.22 111.048 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.453 ' CD2' HD21 ' A' ' 66' ' ' LEU . 89.9 m-85 -69.0 178.73 2.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.43 . . . . 75.32 110.824 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.3 tttt -70.77 153.01 43.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.229 -0.441 . . . . 72.51 110.872 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 176.2 -159.95 27.48 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.7 -0.762 . . . . 75.34 112.532 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 68.9 p -60.24 143.0 53.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.831 0.348 . . . . 75.43 110.928 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -177.45 -39.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 75.43 110.934 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.2 m -106.46 -34.43 7.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.069 -0.514 . . . . 74.45 110.88 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 3.9 mp 60.07 158.71 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 73.41 111.121 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -81.02 96.58 7.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.465 . . . . 75.12 110.929 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 34.3 mttt -75.25 157.58 34.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.448 . . . . 75.22 110.908 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 7.5 m -158.7 -44.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 63.13 111.173 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.4 m 61.65 103.26 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.042 -0.526 . . . . 73.03 110.924 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -152.3 137.5 17.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 74.32 110.885 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -77.3 151.77 34.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 73.42 110.972 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -167.54 -42.86 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.928 -0.578 . . . . 74.34 111.085 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -166.35 146.62 6.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.996 -0.547 . . . . 73.13 110.898 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -78.05 91.79 4.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 72.14 110.891 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 14.5 m -143.37 141.1 26.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.212 -0.449 . . . . 73.3 111.106 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.83 -32.84 7.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.215 -0.448 . . . . 75.23 110.876 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -87.79 144.17 26.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 72.41 110.923 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -169.21 111.17 0.49 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 65.32 110.918 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -107.82 -32.9 7.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 72.13 110.878 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -154.24 115.97 4.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 74.1 110.901 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.64 87.42 0.95 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 75.41 110.914 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.8 106.58 1.69 Allowed 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.535 2.157 . . . . 72.25 112.335 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 7.2 mmmt -110.39 -32.85 6.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 72.31 110.915 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -120.66 151.76 39.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.446 . . . . 74.51 110.91 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 40.4 p -135.63 109.45 8.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 75.11 110.925 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.7 mmtp -107.36 -32.94 7.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 71.04 110.896 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -113.44 130.11 56.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 74.51 110.907 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -160.56 87.72 0.76 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 74.2 110.874 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -151.97 117.21 5.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 74.12 110.943 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.8 m -140.6 32.48 1.84 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.169 -0.468 . . . . 65.51 110.945 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.7 mt 60.32 103.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 64.34 110.861 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -84.5 -31.35 24.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.27 -0.423 . . . . 55.23 110.981 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -125.71 88.08 2.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 74.33 110.9 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -163.29 128.42 1.84 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.731 -0.747 . . . . 70.32 112.456 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.513 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 32.0 Cg_exo -56.7 -45.97 33.0 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.401 2.067 . . . . 73.53 112.881 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.513 ' CD ' ' N ' ' A' ' 108' ' ' PRO . 91.5 Cg_endo -82.18 -172.54 1.47 Allowed 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 123.051 2.5 . . . . 74.1 112.435 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.42 ' HE2' ' CD1' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -132.56 29.31 4.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 75.4 110.967 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 19.1 p90 -130.88 151.06 51.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 75.14 110.819 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 4.8 m -120.27 128.7 53.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.272 -0.422 . . . . 74.12 110.683 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -124.66 144.25 50.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.338 -0.392 . . . . 75.25 111.0 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.1 t -145.36 117.18 8.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 65.1 110.909 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 24.1 t -74.78 107.31 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 74.4 111.147 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -77.45 -53.93 7.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 74.13 111.005 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -120.68 108.19 13.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 74.52 111.096 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.75 149.63 21.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 74.2 110.87 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.519 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -121.88 -155.04 9.32 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.637 -0.792 . . . . 74.15 112.662 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -37.93 -53.4 1.34 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.964 0.411 . . . . 74.51 111.436 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.65 36.04 1.32 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.87 -0.604 . . . . 75.31 110.18 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 24.2 m -153.53 -44.09 0.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.645 -0.707 . . . . 74.52 110.663 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -92.82 96.71 10.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 62.54 110.819 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -108.76 151.27 41.67 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 74.32 110.893 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.04 125.59 19.7 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.517 2.145 . . . . 60.42 112.36 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -101.91 145.55 29.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.098 -0.501 . . . . 74.52 110.9 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -55.21 113.32 1.34 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.255 -0.429 . . . . 63.4 110.95 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.23 -19.61 48.05 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.644 -0.789 . . . . 73.03 112.577 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.59 138.22 31.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.8 0.333 . . . . 75.44 110.823 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.538 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 20.8 m -68.58 172.1 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.05 0.452 . . . . 73.25 111.415 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.687 ' O ' ' HA ' ' A' ' 163' ' ' SER . 19.5 m -156.75 144.36 10.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.612 -0.722 . . . . 74.43 110.19 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.481 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.76 117.85 22.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.759 0.314 . . . . 71.24 110.99 -179.85 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.42 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 27.0 p -154.76 168.82 25.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.36 -0.382 . . . . 74.14 111.093 -179.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.421 ' CE3' HG13 ' A' ' 149' ' ' ILE . 75.5 m95 -102.18 161.58 13.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.057 -0.52 . . . . 64.43 110.129 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.431 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 14.1 p90 -159.27 135.05 8.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.042 0.449 . . . . 72.21 111.65 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.45 112.92 15.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.792 -0.64 . . . . 74.44 110.394 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.527 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.94 144.88 17.6 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.564 -0.827 . . . . 64.14 113.137 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -151.25 140.64 21.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.725 0.298 . . . . 65.15 110.473 179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 99.2 mt -78.09 -178.04 5.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.325 -0.398 . . . . 73.25 111.173 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -59.04 -42.89 91.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.969 -0.559 . . . . 74.13 110.857 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.31 -4.68 37.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.976 -0.556 . . . . 74.43 111.413 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.47 22.0 38.8 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.687 -0.768 . . . . 74.31 112.696 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.85 108.31 19.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.859 0.362 . . . . 74.44 110.683 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 m -68.33 130.33 33.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 73.1 111.247 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -110.95 -31.04 7.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 65.52 110.919 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -140.23 124.8 18.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 74.43 110.983 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 29.4 m -142.59 102.86 4.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 74.44 110.736 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . 0.431 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 45.3 t30 -76.15 -6.27 50.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 73.11 111.387 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.447 ' CD1' ' N ' ' A' ' 149' ' ' ILE . 2.6 mp -95.54 115.98 35.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.844 0.354 . . . . 71.14 111.036 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.56 -74.73 0.64 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.153 -0.476 . . . . 74.13 110.903 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 72.3 p -142.18 166.01 25.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.27 -0.423 . . . . 75.35 110.893 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 14.7 m -82.72 170.2 15.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 64.3 110.927 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -80.96 -27.42 36.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 55.24 111.172 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.05 -31.89 65.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.31 -0.405 . . . . 73.03 111.043 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 20.2 tttp -89.63 -33.82 16.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.445 . . . . 62.54 110.857 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -177.17 138.27 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 72.45 110.857 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.49 77.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 75.12 110.843 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -142.27 47.62 1.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 74.33 110.835 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -140.23 120.79 14.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.459 . . . . 73.31 111.083 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 17.9 mttt -146.42 109.16 4.19 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 73.33 110.917 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.63 150.37 12.18 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.442 2.095 . . . . 74.42 112.327 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 3.7 tt -74.21 119.28 18.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 75.31 110.631 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.687 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.45 122.1 42.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.885 0.374 . . . . 73.05 111.237 -179.813 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -151.52 143.1 23.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 74.43 110.874 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 64.3 mttt -78.0 138.28 38.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.037 0.446 . . . . 72.4 111.151 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 28.6 m -87.78 149.11 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.831 -0.622 . . . . 74.11 111.133 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.03 22.57 78.48 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.858 -0.687 . . . . 60.33 112.737 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 17.9 m -128.55 42.87 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.846 0.355 . . . . 63.44 111.172 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 40.48 38.19 1.39 Allowed Glycine 0 C--N 1.333 0.391 0 CA-C-N 116.013 -0.54 . . . . 74.31 113.461 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.64 -47.1 10.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.862 0.363 . . . . 74.41 111.131 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.9 m -112.04 -179.9 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.072 -0.513 . . . . 72.44 111.079 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.516 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -60.54 160.62 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.303 -0.408 . . . . 72.25 111.377 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -67.72 -25.83 65.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.1 -0.5 . . . . 75.35 111.285 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -80.31 -33.69 31.33 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.63 -0.795 . . . . 60.13 112.399 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.516 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.5 t90 -80.8 -35.69 32.68 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.071 0.397 . . . . 73.34 112.071 -179.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 7.0 p30 -73.04 -31.35 64.37 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.794 0.33 . . . . 72.44 110.277 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -74.59 -30.65 61.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 72.32 110.18 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -88.0 -45.25 10.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.012 -0.54 . . . . 61.12 111.132 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.477 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 4.8 mt -57.68 -38.7 75.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.13 -0.486 . . . . 74.2 110.607 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 16.5 mt -55.4 -24.19 28.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.124 -0.489 . . . . 74.4 110.937 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.0 -3.99 56.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.227 -0.442 . . . . 71.23 111.417 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.55 154.09 27.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.776 0.322 . . . . 72.5 110.623 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.08 171.52 8.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.977 0.418 . . . . 74.22 111.447 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -64.72 120.73 13.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.788 -0.642 . . . . 72.43 110.506 179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 67.85 63.8 3.49 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.543 -0.837 . . . . 64.35 112.19 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . 0.519 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 22.3 tt0 -144.57 147.03 32.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.633 0.254 . . . . 74.25 110.403 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -119.42 136.53 54.26 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.271 -0.27 . . . . 71.43 110.271 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.28 168.53 19.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.105 0.479 . . . . 54.44 111.811 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.66 101.01 4.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.589 -0.732 . . . . 74.31 109.874 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -118.92 145.33 45.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.069 0.462 . . . . 75.41 111.884 -178.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . 0.42 ' HA ' ' HA ' ' A' ' 215' ' ' THR . 16.2 pt-20 -118.14 116.21 26.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.625 -0.716 . . . . 74.23 110.248 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . . . . . . . . . 25.5 mt -106.89 128.7 61.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.279 -0.419 . . . . 64.44 111.589 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -61.65 164.9 8.42 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.902 -0.59 . . . . 74.22 110.615 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . 0.413 ' HG3' ' HA ' ' A' ' 211' ' ' ASN . 19.6 Cg_endo -58.68 -40.04 76.92 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.591 2.194 . . . . 64.31 112.291 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -53.54 -28.27 30.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 74.44 111.302 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . 0.42 ' CD1' ' HE2' ' A' ' 110' ' ' LYS . 13.8 m0 -110.24 35.3 3.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.845 0.355 . . . . 74.15 111.091 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -153.74 -79.93 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 74.23 111.071 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.4 ' CE2' HD11 ' A' ' 214' ' ' LEU . 19.3 m-85 -108.37 -33.69 7.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.405 . . . . 72.13 110.771 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 111.36 177.7 20.32 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.827 -0.701 . . . . 60.55 112.652 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -59.22 -36.32 75.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 74.45 110.838 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.13 -53.15 61.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 75.04 110.653 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 119.95 -151.81 17.25 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.943 -0.646 . . . . 73.12 112.494 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -143.98 78.14 14.16 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.905 0.383 . . . . 72.53 110.579 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -55.65 -21.7 32.79 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.599 2.2 . . . . 74.31 112.381 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.52 -42.12 99.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.419 -0.355 . . . . 75.12 110.955 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -111.9 22.68 14.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.188 -0.46 . . . . 72.04 111.356 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 21.5 mttp 58.52 54.46 5.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.916 0.389 . . . . 75.04 111.057 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . . . . . . . . . 23.0 mm -108.81 111.81 60.67 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 72.03 111.017 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.75 163.2 3.04 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.475 2.117 . . . . 73.32 112.447 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.04 128.72 13.37 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.634 2.222 . . . . 74.54 112.338 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . 0.413 ' HA ' ' HG3' ' A' ' 194' ' ' PRO . 22.8 m-80 62.6 66.99 0.73 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.249 -0.432 . . . . 74.54 110.908 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.87 129.74 51.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.264 -0.425 . . . . 74.44 111.539 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.4 143.95 57.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.942 -0.572 . . . . 74.11 110.469 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.4 HD11 ' CE2' ' A' ' 198' ' ' TYR . 9.6 mt -126.94 109.58 12.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.94 0.4 . . . . 75.24 111.779 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 215' ' ' THR . . . . . 0.42 ' HA ' ' HA ' ' A' ' 191' ' ' GLU . 2.7 m -107.67 138.05 44.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.974 -0.557 . . . . 75.21 110.436 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.527 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 22.7 p90 -152.41 175.31 12.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.094 0.473 . . . . 73.1 111.542 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -130.28 134.1 46.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.734 -0.666 . . . . 74.01 110.432 179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . 0.403 HG11 ' N ' ' A' ' 219' ' ' GLU . 5.8 t -121.73 150.43 25.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.997 0.427 . . . . 74.31 111.898 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . 0.403 ' N ' HG11 ' A' ' 218' ' ' VAL . 14.7 tt0 -136.94 109.22 7.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.762 -0.654 . . . . 75.13 110.233 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . 0.42 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 1.9 tt -70.06 133.25 47.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.504 -0.316 . . . . 65.41 110.975 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 21.9 t -112.62 -29.53 2.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.238 -0.437 . . . . 72.32 111.451 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . 0.419 ' HB3' ' CD2' ' A' ' 132' ' ' HIS . 9.4 t70 -169.03 158.59 8.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.907 0.384 . . . . 74.32 111.157 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 30.7 mt -141.52 111.53 3.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.109 -0.496 . . . . 74.31 111.182 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 33.8 t70 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.245 -0.434 . . . . 63.52 110.871 179.884 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.832 0.349 . . . . 74.15 111.163 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.78 112.93 26.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.474 . . . . 73.54 111.084 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -101.6 107.4 18.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 63.54 111.108 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.4 ' CB ' ' CG2' ' A' ' 215' ' ' THR . . . -85.98 174.61 9.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 74.01 111.067 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.4 ' CG1' ' CG2' ' A' ' 136' ' ' THR . 29.9 t -60.18 110.54 2.93 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.467 . . . . 75.13 111.103 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -79.68 142.53 16.16 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.65 2.234 . . . . 62.1 112.449 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -78.54 147.91 33.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.244 -0.435 . . . . 74.51 110.785 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.97 96.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.213 -0.449 . . . . 74.22 111.285 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.99 -15.62 63.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 72.41 111.379 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.468 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 2.0 m-90 -135.64 173.79 11.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.907 0.384 . . . . 73.31 110.794 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -117.0 153.26 32.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.978 -0.555 . . . . 73.01 110.517 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.7 t -56.31 -34.05 39.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.396 . . . . 74.45 110.975 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -72.8 -25.67 61.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.532 . . . . 73.15 111.197 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -82.15 -56.57 3.85 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.821 0.343 . . . . 75.23 111.122 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.0 mt -49.55 -64.36 0.83 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.284 -0.417 . . . . 74.13 111.123 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -54.45 -25.46 25.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.5 . . . . 73.34 111.345 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.13 173.24 0.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.023 0.44 . . . . 73.43 111.31 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -108.25 16.99 22.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.766 -0.652 . . . . 75.23 110.945 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -107.75 -23.61 12.02 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.386 -0.37 . . . . 74.41 111.065 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.468 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 10.0 tt -93.17 116.19 66.12 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.407 -0.36 . . . . 74.32 111.029 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -57.2 126.6 22.61 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.478 2.118 . . . . 74.12 112.198 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -24.11 67.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 72.43 111.203 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.4 mmtt -53.74 -36.87 62.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.375 -0.375 . . . . 74.45 111.292 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -72.67 -57.22 4.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.266 -0.425 . . . . 73.51 111.021 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.47 HD13 HG21 ' A' ' 25' ' ' ILE . 36.5 mt -44.77 -30.56 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.892 -0.594 . . . . 71.23 111.466 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.7 mt -78.08 -38.83 24.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.931 0.396 . . . . 75.52 111.03 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 mtpt -73.78 -24.9 59.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.96 -0.564 . . . . 74.41 111.131 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -72.96 -45.19 59.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.923 0.392 . . . . 75.52 110.842 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.2 mt -69.27 -24.53 63.98 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.911 -0.586 . . . . 75.22 111.033 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -80.0 -26.89 39.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.407 . . . . 63.54 111.112 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.427 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -101.8 -1.3 32.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.415 -0.357 . . . . 71.34 111.593 -179.889 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.427 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.7 m-70 -132.6 -10.9 3.14 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.857 0.317 . . . . 74.54 111.857 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.86 105.49 0.81 Allowed Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.603 -0.808 . . . . 65.32 112.372 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -31.94 152.48 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.544 0.572 . . . . 63.45 112.544 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -50.09 -56.8 9.41 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.692 -0.685 . . . . 71.21 111.292 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.52 -49.96 17.82 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.032 0.444 . . . . 71.42 110.77 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.447 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 2.4 t80 -52.99 -47.26 68.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.786 -0.643 . . . . 74.1 110.321 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.416 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 12.1 mt -66.86 -41.48 87.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.938 -0.574 . . . . 74.32 110.853 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.64 -41.84 32.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.093 0.473 . . . . 52.12 110.75 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -49.4 -48.28 47.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.678 -0.692 . . . . 72.33 110.93 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.418 ' CD2' ' N ' ' A' ' 41' ' ' HIS . 2.9 m-70 -103.89 14.86 29.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.042 -0.526 . . . . 74.34 111.201 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 4.8 mtmm 55.51 42.14 30.09 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.889 0.376 . . . . 71.54 111.1 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 20.3 mt -93.24 -19.43 21.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 72.44 111.532 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.416 ' N ' ' HB3' ' A' ' 38' ' ' LEU . 0.3 OUTLIER -79.73 157.81 27.07 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.04 0.448 . . . . 75.43 111.077 -179.863 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.73 -121.55 5.13 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.747 -0.661 . . . . 51.13 112.379 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -116.36 116.88 28.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.773 0.321 . . . . 72.5 110.92 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mp -45.9 -54.72 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.237 -0.438 . . . . 73.32 111.33 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -47.09 -36.75 8.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 74.51 110.849 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -85.67 -26.03 26.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.93 -0.577 . . . . 73.42 110.959 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 22.8 t -79.8 -26.03 12.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.293 -0.412 . . . . 72.11 111.353 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.61 -23.13 66.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 70.24 111.126 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.21 -30.43 14.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 72.2 110.758 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.2 m -98.2 33.74 2.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 62.14 111.053 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -165.4 135.05 3.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 63.25 111.027 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -94.03 177.33 6.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 74.11 110.964 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.04 -57.79 10.63 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.26 -0.427 . . . . 73.24 111.053 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -58.73 -28.31 65.73 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 70.33 110.577 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.27 -47.25 85.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.957 -0.565 . . . . 60.44 110.905 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.7 mt -73.9 -30.94 62.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.654 -0.703 . . . . 74.41 111.283 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 22.3 t -78.84 -43.23 25.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.986 0.422 . . . . 73.34 111.007 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 96.6 m -60.48 -37.84 82.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.945 -0.571 . . . . 72.41 110.71 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.441 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -78.21 -23.41 47.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 63.33 111.081 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -83.96 -53.52 5.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.148 0.499 . . . . 71.14 110.656 179.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -50.56 -57.01 9.15 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.514 -0.766 . . . . 73.24 111.371 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.441 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 3.0 p-80 -63.47 -24.86 68.01 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.155 -0.475 . . . . 74.43 111.193 -179.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.449 HD23 ' CD2' ' A' ' 72' ' ' PHE . 3.7 tt -51.95 -41.39 62.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.907 0.384 . . . . 64.41 110.891 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -79.04 -40.09 32.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.975 -0.557 . . . . 73.25 110.553 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -62.39 -45.19 94.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.979 -0.555 . . . . 71.1 110.676 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 72.7 p -90.75 -1.99 57.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.93 -0.577 . . . . 64.23 111.346 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.1 pttt 45.06 42.16 6.24 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.794 0.331 . . . . 74.31 111.554 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -92.11 47.24 1.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 73.25 110.884 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.449 ' CD2' HD23 ' A' ' 66' ' ' LEU . 87.3 m-85 -73.05 -175.0 1.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 75.44 110.924 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.6 tttt -75.25 153.01 38.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.415 . . . . 75.41 110.857 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -122.67 -143.81 6.53 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.771 -0.728 . . . . 62.11 112.49 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.58 99.47 8.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.827 0.346 . . . . 73.22 110.879 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -108.42 -32.55 7.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.455 . . . . 62.43 110.856 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.1 m -95.79 150.67 20.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 71.34 110.91 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 25.0 mm -140.64 92.44 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 73.51 111.118 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.8 t -75.04 -33.34 61.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 74.41 110.948 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.8 ttpt 60.09 109.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 75.54 110.946 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -93.32 81.97 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.459 . . . . 74.51 111.129 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -176.82 138.91 0.28 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 73.24 110.893 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -177.9 -39.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 74.34 110.874 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -82.88 102.54 11.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.098 -0.501 . . . . 62.12 110.918 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -133.32 101.52 4.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 75.42 111.127 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -147.99 131.28 16.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 74.31 110.913 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -73.84 102.47 4.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 75.4 110.901 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 6.7 m -157.67 166.76 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 71.42 111.147 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.1 -32.07 11.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 75.52 110.928 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.3 tt -142.48 107.71 4.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 74.44 110.894 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -136.24 112.26 9.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 64.04 110.908 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -157.4 152.19 25.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.145 -0.48 . . . . 65.3 110.895 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -177.11 -39.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 71.04 110.954 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -169.28 143.99 2.48 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.088 -0.506 . . . . 73.31 110.879 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.77 139.85 58.12 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.453 2.102 . . . . 72.35 112.304 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -109.14 -29.77 8.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 74.13 110.972 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -130.32 -79.05 0.54 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.456 . . . . 74.51 110.939 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.64 102.87 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.203 -0.453 . . . . 75.41 110.934 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.5 mttt -141.54 127.99 20.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 75.34 110.945 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.8 m 60.91 91.81 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 73.32 110.894 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.67 100.95 7.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 72.04 110.94 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -106.46 144.34 33.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 65.1 110.919 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 20.8 p -131.77 151.7 51.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.21 -0.45 . . . . 74.44 110.875 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -159.18 149.25 19.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 74.21 110.94 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -151.83 -173.12 4.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 64.21 110.888 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 62.49 -80.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.111 -0.495 . . . . 73.35 111.041 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 169.92 80.98 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.799 -0.715 . . . . 65.43 112.477 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.19 154.77 65.72 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.597 2.198 . . . . 64.43 112.301 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -68.89 -166.94 0.17 Allowed 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.577 2.185 . . . . 73.3 112.28 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.416 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -97.49 30.69 2.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 75.4 110.962 179.987 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.423 ' CE1' ' HB3' ' A' ' 178' ' ' ALA . 47.3 p90 -151.98 163.73 38.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 74.15 110.852 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.42 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 64.1 m -130.2 103.57 6.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 73.55 110.939 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.46 146.42 34.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 75.21 110.897 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 2.1 m -142.23 125.75 16.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 74.43 110.925 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 41.8 t -72.68 106.11 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 75.24 111.451 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.8 mp -75.62 -60.71 2.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 73.32 110.484 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.0 ttpp -111.62 108.07 17.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.954 -0.566 . . . . 73.44 110.64 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.4 mtpt -60.21 137.37 58.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.26 -0.427 . . . . 72.35 111.024 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -104.19 -106.01 3.05 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.762 -0.733 . . . . 61.33 112.198 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.22 -43.94 11.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.958 0.408 . . . . 75.44 110.589 179.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 71.05 36.44 1.42 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.909 -0.587 . . . . 73.52 110.679 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 60.1 m -163.97 -43.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.017 -0.538 . . . . 74.41 110.768 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.35 91.72 6.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 73.21 110.952 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -103.34 149.89 37.43 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.129 -0.487 . . . . 74.43 110.906 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.14 125.66 10.5 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.597 2.198 . . . . 75.03 112.387 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.91 159.38 15.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 72.55 110.8 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.53 118.45 5.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.343 -0.39 . . . . 74.52 110.965 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 103.0 -17.72 51.6 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.762 -0.732 . . . . 41.24 112.499 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.41 133.35 35.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.902 0.382 . . . . 74.23 110.903 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.42 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 5.7 p -69.96 162.8 3.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.506 . . . . 63.13 110.848 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.604 ' O ' ' HA ' ' A' ' 163' ' ' SER . 5.4 m -153.16 144.85 15.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.206 -0.452 . . . . 62.33 111.048 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.465 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.48 117.8 22.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.768 0.318 . . . . 74.34 110.725 179.68 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.452 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.1 p -154.76 168.87 25.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.901 0.381 . . . . 73.33 111.067 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -102.91 162.62 12.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.012 -0.54 . . . . 74.33 110.195 179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.41 ' CE1' HD12 ' A' ' 162' ' ' LEU . 33.2 p90 -159.93 135.2 8.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.982 0.42 . . . . 74.13 111.458 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.4 ' CG2' ' CG1' ' A' ' 5' ' ' VAL . 6.8 m -129.32 115.38 17.5 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.847 -0.615 . . . . 74.15 110.337 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.564 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.82 144.26 17.15 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.619 -0.8 . . . . 74.02 113.108 -179.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -148.11 145.98 28.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.784 0.326 . . . . 74.22 110.548 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 21.9 mt -82.27 -177.97 6.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.277 -0.42 . . . . 64.24 111.159 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -57.63 -42.48 83.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 72.32 110.937 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.94 -5.4 46.0 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.016 -0.538 . . . . 63.14 111.405 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.64 25.84 26.64 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.64 -0.79 . . . . 73.53 112.546 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -95.35 112.2 23.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.339 . . . . 75.41 110.771 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . 0.415 ' HA ' ' O ' ' A' ' 137' ' ' GLY . 2.5 m -63.6 144.15 14.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.436 . . . . 73.52 111.17 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.422 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 42.2 p90 -120.92 -36.56 3.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 73.53 111.284 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . 0.414 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 59.7 m-20 -158.07 118.04 3.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.906 0.384 . . . . 71.21 111.355 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 14.7 t -142.94 129.46 20.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.514 . . . . 74.11 110.491 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . 0.408 ' OD1' ' CD1' ' A' ' 135' ' ' TYR . 19.8 p-10 -96.22 39.32 1.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.8 0.333 . . . . 74.33 111.1 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.425 ' CD1' ' N ' ' A' ' 149' ' ' ILE . 2.7 mp -125.64 118.04 51.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 74.31 110.713 179.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -118.29 -77.17 0.57 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.233 -0.439 . . . . 70.22 110.918 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 25.2 p -146.5 166.03 27.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.441 . . . . 62.22 110.942 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.6 m -85.19 -176.33 6.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 74.02 110.892 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -75.25 -23.7 57.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 73.01 111.29 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.6 pttp -54.88 -30.0 57.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.373 -0.376 . . . . 72.15 111.087 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -91.29 -38.17 12.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 74.42 110.89 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 30.0 pttt -179.18 156.89 0.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.061 -0.518 . . . . 74.41 110.859 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 4.9 mtmt -86.12 76.22 9.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 71.42 110.892 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -154.12 47.67 0.61 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.479 . . . . 74.15 110.835 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.19 111.48 2.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.056 -0.52 . . . . 65.21 111.04 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -136.83 138.4 26.01 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 73.45 110.904 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.76 151.62 31.6 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.384 2.056 . . . . 72.41 112.359 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.41 HD12 ' CE1' ' A' ' 135' ' ' TYR . 4.6 tt -76.08 119.95 20.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 73.23 110.572 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.604 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -98.68 122.17 41.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.907 0.384 . . . . 72.51 111.273 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . 0.424 ' CE1' ' CG2' ' A' ' 131' ' ' VAL . 8.4 p90 -151.62 143.55 23.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.014 -0.539 . . . . 75.1 110.724 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 14.7 mtmm -80.92 139.11 36.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.082 0.468 . . . . 74.42 111.129 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.1 m -87.46 149.46 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.71 -0.677 . . . . 72.31 111.44 -179.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.51 22.54 77.84 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.82 -0.627 . . . . 64.14 112.768 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 17.1 m -129.38 42.29 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 75.42 111.096 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.69 37.47 5.14 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 121.143 -0.551 . . . . 73.22 113.088 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -86.02 -36.8 19.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.819 0.342 . . . . 74.52 111.131 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.6 m -126.76 179.39 3.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.457 . . . . 72.21 111.19 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.51 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -60.57 159.45 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 73.32 111.301 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -67.41 -27.8 67.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 74.41 111.199 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.96 -36.97 39.75 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.662 -0.78 . . . . 74.04 112.059 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.512 ' CD1' ' HG ' ' A' ' 179' ' ' LEU . 2.4 t90 -78.3 -34.15 48.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.957 0.408 . . . . 74.4 111.113 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.78 -32.21 73.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.948 -0.569 . . . . 62.34 110.675 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -79.06 -29.82 43.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.48 . . . . 73.13 110.837 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . 0.423 ' HB3' ' CE1' ' A' ' 111' ' ' TYR . . . -82.58 -52.38 6.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.234 -0.439 . . . . 75.44 111.181 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.512 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 10.2 mt -58.4 -34.89 71.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.988 -0.551 . . . . 73.22 110.842 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.6 mp -53.68 -37.62 63.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 72.2 111.084 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 39.2 p -84.18 1.99 41.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.037 -0.529 . . . . 73.03 111.518 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.15 151.38 33.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.765 0.317 . . . . 73.42 110.863 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.72 165.76 11.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.291 -0.413 . . . . 71.42 110.938 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.89 124.97 23.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.08 -0.509 . . . . 74.15 111.021 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 67.8 44.15 81.25 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.84 -0.695 . . . . 74.44 112.841 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . 0.4 ' HG2' ' N ' ' A' ' 187' ' ' LYS . 13.4 tt0 -126.91 149.94 49.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.581 0.229 . . . . 61.44 110.528 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . 0.4 ' N ' ' HG2' ' A' ' 186' ' ' GLU . 4.7 ttmt -117.95 138.17 52.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.098 -0.334 . . . . 72.32 110.098 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -148.23 175.85 10.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.075 0.464 . . . . 61.21 111.846 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.13 133.6 33.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.607 -0.724 . . . . 71.43 109.584 178.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.423 ' HG ' ' CE1' ' A' ' 216' ' ' PHE . 1.1 pt? -140.34 141.18 35.69 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.158 0.504 . . . . 73.53 112.045 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.68 110.36 18.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.587 -0.733 . . . . 72.34 110.257 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.449 ' CD1' ' CE2' ' A' ' 216' ' ' PHE . 2.1 mp -96.25 139.44 19.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.916 0.389 . . . . 74.12 111.344 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -73.64 166.38 44.69 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.945 -0.57 . . . . 74.35 110.964 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.56 -14.34 41.87 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.676 2.25 . . . . 73.44 112.608 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -80.38 -30.01 37.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.814 0.34 . . . . 72.43 111.028 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . 0.416 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 15.3 m0 -111.06 36.9 2.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.29 -0.413 . . . . 71.33 111.004 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -153.16 -78.4 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.256 -0.429 . . . . 74.52 111.018 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.44 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 24.0 m-85 -106.92 -71.17 0.76 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 71.13 110.792 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 145.74 176.04 19.32 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.83 -0.7 . . . . 51.43 112.596 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -57.5 -25.58 60.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.728 0.299 . . . . 72.22 111.005 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -74.68 -52.02 12.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.998 0.427 . . . . 74.25 110.863 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.78 174.01 24.67 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.854 -0.689 . . . . 54.21 112.533 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . 0.415 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.0 OUTLIER -106.32 91.27 5.54 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.66 0.267 . . . . 75.1 110.845 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.22 -21.61 54.84 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.509 2.139 . . . . 74.01 112.445 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.39 -41.84 94.65 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.383 -0.371 . . . . 71.11 110.932 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -105.96 30.0 6.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 72.32 111.126 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 21.6 mttp 56.8 29.43 16.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 73.15 111.044 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . 0.423 HD11 ' CE2' ' A' ' 198' ' ' TYR . 30.3 mt -91.11 111.77 50.3 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.304 -0.407 . . . . 64.24 111.013 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -68.55 171.23 13.43 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.461 2.107 . . . . 73.44 112.401 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -67.01 145.84 75.16 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.587 2.191 . . . . 74.41 112.253 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 48.92 73.61 0.22 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.255 -0.429 . . . . 71.25 111.152 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -127.37 113.66 16.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.312 -0.404 . . . . 53.45 111.479 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.08 116.5 6.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.054 -0.521 . . . . 74.04 110.44 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.44 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 11.1 mt -93.46 109.87 21.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.162 -0.472 . . . . 63.14 111.568 -179.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 215' ' ' THR . . . . . 0.4 ' CG2' ' CB ' ' A' ' 4' ' ' ALA . 96.4 m -107.43 138.13 44.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.935 -0.575 . . . . 65.15 110.303 179.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.564 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 14.9 p90 -155.33 179.38 9.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.082 0.467 . . . . 75.13 111.552 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -133.48 136.85 45.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.686 -0.688 . . . . 75.31 110.748 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.0 t -121.8 151.21 25.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.168 -0.469 . . . . 53.5 111.756 -179.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -136.74 108.78 7.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.793 -0.639 . . . . 71.22 110.365 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . 0.452 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 0.7 OUTLIER -69.83 128.56 36.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.364 -0.38 . . . . 74.22 110.829 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 39.3 t -108.7 -30.05 2.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.25 -0.432 . . . . 75.45 111.023 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -167.14 156.81 10.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.354 -0.384 . . . . 72.42 110.948 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 4.4 mp -142.75 112.35 2.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.239 -0.437 . . . . 75.43 111.097 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 73.52 110.89 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.854 0.359 . . . . 64.0 111.149 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.7 105.1 15.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 72.01 111.107 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -158.68 59.56 0.43 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 74.42 111.037 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -164.55 123.91 1.9 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 72.42 111.052 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.4 ' CG1' ' CG2' ' A' ' 136' ' ' THR . 44.7 t -60.21 110.46 2.87 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 72.12 110.951 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.443 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 80.3 Cg_endo -78.56 141.96 18.0 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.713 2.275 . . . . 70.14 112.473 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -79.91 149.35 30.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.126 -0.488 . . . . 73.45 110.975 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.406 ' HG3' ' CE2' ' A' ' 67' ' ' PHE . 0.0 OUTLIER -49.86 116.61 1.88 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 74.13 111.162 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.29 -13.9 34.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.146 -0.479 . . . . 74.11 111.576 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.45 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 2.0 m-90 -137.94 173.73 11.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.961 0.41 . . . . 73.41 110.966 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 m -117.51 151.8 36.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.944 -0.571 . . . . 71.2 110.741 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.8 t -56.7 -33.09 39.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.948 0.404 . . . . 64.55 110.824 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -75.4 -25.61 57.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.949 -0.568 . . . . 75.32 111.017 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -82.12 -57.45 3.39 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.831 0.348 . . . . 74.14 110.929 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -49.7 -62.98 1.25 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.241 -0.436 . . . . 73.5 111.006 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 17.9 mtt180 -54.07 -24.09 16.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.087 -0.506 . . . . 70.22 111.291 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.31 176.84 0.11 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.891 0.377 . . . . 72.41 111.168 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -110.38 16.81 21.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.98 -0.554 . . . . 72.55 111.194 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -108.9 -24.81 11.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.521 -0.309 . . . . 75.43 111.165 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.45 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 1.8 tt -90.95 111.69 49.59 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.388 -0.369 . . . . 75.4 111.03 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -55.97 128.09 28.8 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.448 2.099 . . . . 75.22 112.211 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -24.16 67.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 73.32 111.222 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.04 -41.62 62.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.425 -0.352 . . . . 75.3 111.472 -179.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.95 -57.34 4.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.197 -0.456 . . . . 53.21 111.104 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 4.9 mt -44.96 -30.49 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.858 -0.61 . . . . 70.4 111.613 -179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.5 mt -77.74 -37.85 24.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.938 0.399 . . . . 73.34 110.969 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -73.11 -23.75 60.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.062 -0.517 . . . . 75.1 111.03 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.452 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 34.6 t80 -73.22 -47.02 46.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.06 0.457 . . . . 75.21 110.99 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 mt -69.11 -27.77 65.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.782 -0.645 . . . . 74.23 111.136 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -75.69 -29.26 58.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.405 . . . . 72.41 110.987 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -93.34 -39.65 10.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 71.21 111.113 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.452 ' ND1' ' CZ ' ' A' ' 28' ' ' PHE . 18.3 m170 -90.27 -5.0 56.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.294 -0.412 . . . . 64.41 111.448 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.01 161.94 15.96 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.712 -0.756 . . . . 70.45 112.425 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.81 153.38 18.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.62 0.248 . . . . 72.13 110.501 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -48.83 -56.97 7.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.77 0.319 . . . . 74.42 111.066 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.14 -51.24 25.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.053 0.454 . . . . 71.24 110.803 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.508 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 16.5 t80 -53.07 -48.09 67.98 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.803 -0.635 . . . . 71.53 110.453 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 13.3 mt -66.18 -40.67 90.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.055 -0.521 . . . . 74.53 110.775 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.432 ' CB ' HD22 ' A' ' 44' ' ' LEU . . . -47.65 -48.19 28.96 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.03 0.443 . . . . 62.13 111.1 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -57.33 -26.68 61.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.713 -0.676 . . . . 70.43 110.94 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.406 ' NE2' ' CE1' ' A' ' 65' ' ' HIS . 67.8 m-70 -112.57 11.07 19.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.283 -0.417 . . . . 74.54 111.248 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.89 34.79 11.0 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.817 0.341 . . . . 75.14 110.901 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 23.2 mt -93.29 -20.65 20.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 74.13 111.736 -179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.432 HD22 ' CB ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.39 158.89 27.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.031 0.443 . . . . 72.42 111.102 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.61 -119.6 4.64 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.775 -0.648 . . . . 51.53 112.453 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.4 115.16 25.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.803 0.335 . . . . 72.41 110.891 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mp -45.41 -57.66 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.164 -0.471 . . . . 75.21 111.499 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -45.68 -37.25 5.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.804 -0.634 . . . . 74.43 111.076 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -85.75 -25.92 26.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.566 . . . . 71.31 111.086 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 19.2 t -81.14 -26.36 10.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.304 -0.407 . . . . 73.11 111.459 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.99 -18.02 64.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.403 -0.362 . . . . 74.24 111.365 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -95.2 -34.53 12.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.42 -0.355 . . . . 73.43 111.076 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.46 -19.74 35.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 74.22 111.409 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -116.16 139.26 50.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 74.35 111.255 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -91.42 -177.47 4.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.151 -0.477 . . . . 74.13 110.74 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.1 mmmt -59.59 -58.02 10.42 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.457 -0.338 . . . . 73.05 110.91 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.94 -27.87 65.73 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.205 -0.452 . . . . 74.44 110.625 179.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.77 -43.11 99.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.958 -0.564 . . . . 73.31 110.756 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 29.1 mt -76.35 -28.85 56.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.687 -0.688 . . . . 75.1 111.196 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 18.2 t -80.42 -43.93 21.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.001 0.429 . . . . 72.44 110.685 179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 72.4 m -59.29 -33.98 71.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.88 -0.6 . . . . 72.22 110.457 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -83.23 -21.97 33.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 71.31 110.942 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -83.64 -22.84 32.05 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.171 -0.468 . . . . 75.31 111.113 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -84.56 -53.9 5.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.074 0.464 . . . . 70.04 111.321 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.508 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.9 p-80 -60.43 -29.23 68.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.003 -0.544 . . . . 74.23 111.022 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.457 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.5 tt -46.73 -42.09 16.17 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.877 0.37 . . . . 71.33 110.985 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.406 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 5.8 m-85 -78.14 -41.08 36.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.997 -0.547 . . . . 70.42 110.276 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -70.31 -13.02 61.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.899 -0.592 . . . . 75.1 111.02 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.444 ' N ' ' O ' ' A' ' 65' ' ' HIS . 39.3 p -110.6 -16.16 13.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.267 -0.424 . . . . 75.53 111.259 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.9 mtmm 57.41 29.95 17.79 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.784 0.326 . . . . 73.32 111.043 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.1 mtt85 -95.1 44.07 1.09 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 71.45 110.993 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.442 ' CD2' HD21 ' A' ' 66' ' ' LEU . 61.5 m-85 -66.29 174.63 2.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 74.14 110.758 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -69.25 113.02 6.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.293 -0.412 . . . . 75.34 110.856 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -102.92 -179.44 26.51 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.722 -0.752 . . . . 75.12 112.478 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 40.9 p -84.77 140.27 31.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.862 0.363 . . . . 72.22 110.895 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -152.56 117.01 4.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 72.42 110.893 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 5.5 t 61.35 154.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 72.3 110.893 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 4.7 mt -117.6 114.31 45.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.446 . . . . 71.22 111.111 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.73 164.9 16.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 72.25 110.936 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 28.6 tttt -107.11 147.05 30.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 75.41 110.899 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 12.9 m -84.92 -31.88 7.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 71.32 111.118 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.9 m -80.4 172.62 13.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 75.23 110.904 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -177.6 -39.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 72.41 110.964 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -97.38 -32.86 11.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.103 -0.499 . . . . 65.21 110.905 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.2 p -138.36 116.38 12.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.449 . . . . 75.54 111.082 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.6 145.54 43.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.431 . . . . 72.5 110.913 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -130.49 117.66 19.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 71.32 110.873 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 11.1 p -159.04 113.27 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 73.24 111.075 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.28 81.37 0.18 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 71.43 110.878 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.3 mt -148.86 157.03 43.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 72.34 110.918 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -83.31 -31.88 26.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 74.44 110.931 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -86.65 145.52 26.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 74.22 110.931 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -140.87 133.83 29.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 73.32 110.913 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -147.5 149.25 33.65 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 74.33 110.901 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.5 130.95 19.25 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.548 2.165 . . . . 62.41 112.341 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? -110.94 -33.71 6.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 74.02 110.92 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -177.13 -39.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 72.31 110.905 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.1 m 60.42 158.41 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.091 -0.504 . . . . 72.02 110.917 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.2 mmtp -109.31 -32.47 7.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 75.11 110.884 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.3 m -164.46 144.29 7.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 65.5 110.896 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -141.35 96.32 2.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.162 -0.472 . . . . 71.23 110.868 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -98.53 -68.33 0.81 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 73.34 110.882 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.3 m 60.22 158.71 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.982 -0.553 . . . . 72.31 110.949 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tp -111.13 145.93 37.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 75.02 110.884 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -174.88 -40.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 73.15 110.915 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -75.74 -31.54 59.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.112 -0.495 . . . . 74.52 110.921 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 74.76 56.95 4.7 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.716 -0.754 . . . . 71.01 112.488 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.07 176.17 7.37 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.583 2.189 . . . . 72.35 112.283 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.411 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 44.0 Cg_exo -56.7 -162.62 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.637 2.225 . . . . 75.15 112.268 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.424 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -98.25 29.07 3.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 72.15 110.97 -179.997 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.411 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 6.2 p90 -160.99 -171.89 3.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 74.2 110.809 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 18.7 m -156.44 103.71 2.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 75.41 111.282 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.3 tttt -100.45 150.99 22.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.202 -0.454 . . . . 73.11 110.66 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 65.6 m -145.49 123.11 11.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.35 -0.386 . . . . 72.43 111.037 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 32.7 t -80.77 106.36 11.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 65.24 111.187 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -82.27 -41.56 20.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.448 . . . . 74.1 110.683 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 8.3 tptt -125.29 108.08 11.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 73.45 110.825 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.0 mtmp? -62.1 139.27 58.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 70.32 110.945 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -110.96 -158.48 15.54 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.719 -0.753 . . . . 70.4 112.408 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -35.88 -49.21 0.61 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.913 0.387 . . . . 75.32 111.708 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 tmtt? 72.89 37.71 0.79 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.994 -0.548 . . . . 75.5 110.298 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -164.43 -44.05 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.729 -0.669 . . . . 63.21 110.55 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -84.82 91.7 8.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.066 -0.515 . . . . 74.24 110.671 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -108.89 154.98 41.55 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.466 . . . . 72.42 110.885 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -73.58 125.63 10.23 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.546 2.164 . . . . 74.13 112.407 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.07 157.37 15.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 71.01 110.891 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.0 115.36 3.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 73.41 110.958 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 108.02 -24.02 24.11 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.732 -0.747 . . . . 71.15 112.568 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -84.54 135.27 34.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 63.13 110.797 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.48 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 22.7 m -68.21 171.69 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.29 -0.414 . . . . 72.42 111.191 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.65 ' O ' ' HA ' ' A' ' 163' ' ' SER . 10.9 m -156.13 145.31 12.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.863 -0.608 . . . . 74.22 110.593 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.437 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.3 OUTLIER -127.6 117.59 22.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.702 0.286 . . . . 75.21 110.818 179.595 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.412 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 30.1 p -153.47 169.09 24.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.965 0.412 . . . . 71.02 111.085 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.422 ' CE3' HG12 ' A' ' 149' ' ' ILE . 39.5 m95 -102.5 160.51 14.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.94 -0.573 . . . . 70.35 110.102 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.434 ' CD1' ' N ' ' A' ' 135' ' ' TYR . 3.2 p90 -158.84 134.7 8.87 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.734 -0.386 . . . . 75.4 111.591 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.4 ' CG2' ' CG1' ' A' ' 5' ' ' VAL . 57.0 m -127.63 112.5 14.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.958 -0.564 . . . . 63.34 110.553 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.617 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.55 143.84 16.81 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.601 -0.809 . . . . 42.43 113.197 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.58 131.01 12.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.724 0.297 . . . . 75.54 110.384 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 83.2 mt -59.24 -178.74 0.06 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.399 -0.364 . . . . 52.23 110.951 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -55.24 -40.9 71.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 65.11 110.852 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.56 0.67 41.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.012 -0.54 . . . . 72.24 111.476 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.75 25.82 26.46 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.612 -0.804 . . . . 72.11 112.64 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.17 108.67 15.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.778 0.323 . . . . 73.42 110.873 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 27.5 t -65.89 124.46 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.449 . . . . 74.12 111.161 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.424 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 17.7 p90 -111.49 -28.41 8.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 71.32 111.013 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -161.19 115.33 2.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.31 -0.405 . . . . 75.45 111.007 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 55.1 m -125.36 116.41 21.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 55.12 110.891 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -86.12 14.65 6.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.921 -0.581 . . . . 55.54 111.636 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.422 HG12 ' CE3' ' A' ' 134' ' ' TRP . 14.8 mt -124.08 122.78 65.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.767 0.318 . . . . 75.52 111.429 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -142.07 -66.67 0.4 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.302 -0.408 . . . . 75.31 111.03 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.59 163.86 12.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.292 -0.413 . . . . 73.25 110.987 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.3 m -116.06 150.41 37.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 73.31 110.814 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.89 71.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 73.11 111.13 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -74.05 -31.46 62.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 71.15 110.911 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -84.61 -34.62 23.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 75.04 110.896 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -177.29 143.55 0.38 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 75.35 110.874 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 25.2 mttm -74.43 76.72 1.91 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 71.14 110.869 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -154.4 40.38 0.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 73.42 110.823 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.2 120.05 3.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.113 -0.494 . . . . 75.43 111.036 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.3 mmtm -138.97 145.94 47.61 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.304 -0.407 . . . . 64.54 110.875 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.09 147.92 61.8 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.492 2.128 . . . . 74.43 112.339 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 3.9 tt -69.38 124.72 24.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 75.4 110.682 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.65 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.29 119.64 38.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.862 0.363 . . . . 53.42 111.081 179.803 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -149.39 140.82 23.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 75.32 110.855 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 75.8 mttt -78.69 139.51 38.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.009 0.433 . . . . 52.31 110.925 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 29.6 m -87.97 148.91 4.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.874 -0.603 . . . . 73.23 111.373 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.1 24.63 74.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.885 -0.674 . . . . 70.3 112.875 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 5.3 m -129.1 42.67 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.821 0.343 . . . . 72.44 111.101 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 41.8 35.45 1.51 Allowed Glycine 0 C--N 1.332 0.33 0 CA-C-N 116.046 -0.525 . . . . 72.23 113.319 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 6.1 mtpp -86.24 -43.65 12.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.814 0.34 . . . . 75.41 111.163 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 5.7 m -115.24 178.17 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.195 -0.457 . . . . 75.23 110.988 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.519 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.92 160.91 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.317 -0.401 . . . . 73.53 111.192 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 3.6 ttp-105 -67.81 -29.05 68.12 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.235 -0.438 . . . . 74.23 111.044 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.9 -37.19 44.9 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.659 -0.781 . . . . 65.14 112.081 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.519 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.0 t90 -78.73 -33.99 46.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.973 0.416 . . . . 75.21 110.983 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -63.87 -33.87 76.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.872 -0.604 . . . . 73.31 110.497 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -78.73 -29.42 45.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.016 -0.538 . . . . 72.31 110.706 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -80.0 -56.11 4.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 64.12 111.126 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.497 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 12.5 mt -61.65 -18.96 61.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.899 -0.592 . . . . 74.45 111.128 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.5 tp -58.38 -27.15 63.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.357 -0.383 . . . . 73.21 111.26 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 47.8 p -111.52 14.01 21.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.494 -0.321 . . . . 75.13 111.717 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.57 100.72 2.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.882 0.372 . . . . 74.44 110.691 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.53 159.46 24.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 75.35 111.255 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.52 116.11 4.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.859 -0.61 . . . . 75.45 111.038 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 79.17 11.84 84.64 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.936 -0.649 . . . . 71.25 113.075 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -87.39 146.31 25.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.963 0.411 . . . . 75.22 111.211 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -119.57 135.71 54.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.003 -0.544 . . . . 71.22 109.928 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -150.11 176.37 10.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.099 0.476 . . . . 63.33 111.9 -179.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.43 138.29 39.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.577 -0.738 . . . . 74.21 109.462 178.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.432 ' CD2' ' CE1' ' A' ' 216' ' ' PHE . 1.1 pt? -140.15 138.16 35.0 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.281 0.562 . . . . 75.22 112.41 -179.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -113.46 112.61 23.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.235 -0.893 . . . . 74.34 109.86 179.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.43 ' CD1' ' CZ ' ' A' ' 216' ' ' PHE . 1.9 mp -106.6 147.08 12.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.001 0.429 . . . . 74.32 111.596 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.407 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.1 OUTLIER -77.1 167.17 38.89 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.902 -0.59 . . . . 74.21 110.61 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 27.8 Cg_endo -62.4 -29.49 79.32 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.464 2.11 . . . . 73.22 112.384 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -66.15 -38.89 89.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.261 -0.427 . . . . 75.35 111.143 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . 0.424 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 18.8 m0 -96.88 36.9 1.35 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.357 -0.383 . . . . 74.41 111.027 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -158.66 -81.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 64.54 110.836 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -106.17 -71.39 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.972 0.415 . . . . 61.54 110.61 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 144.0 -176.0 23.55 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.756 -0.735 . . . . 50.24 112.743 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt -57.36 -35.26 69.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.866 0.365 . . . . 73.43 110.899 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -52.26 62.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 75.13 110.616 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.26 -143.68 15.73 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.878 -0.677 . . . . 74.12 112.559 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -151.97 91.15 3.75 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.606 0.241 . . . . 75.24 110.595 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -61.28 -24.21 78.43 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.548 2.165 . . . . 74.22 112.636 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.69 -42.14 74.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.887 0.375 . . . . 73.15 110.862 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -99.63 26.69 5.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.031 -0.531 . . . . 63.15 111.325 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.53 32.26 13.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.374 -0.376 . . . . 75.35 111.149 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . . . . . . . . . 19.1 mm -93.78 111.76 54.07 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 74.43 111.11 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.44 171.1 14.71 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.362 2.042 . . . . 71.33 112.217 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.33 120.75 7.92 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.492 2.128 . . . . 65.41 112.223 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 63.15 71.23 0.52 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 75.42 110.766 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.09 129.06 50.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 60.33 111.432 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.5 tttt -65.43 139.4 58.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.022 -0.535 . . . . 75.33 110.723 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.87 109.6 15.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.416 -0.356 . . . . 74.32 111.318 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 61.2 m -107.88 141.83 38.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 61.53 110.643 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.617 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 27.0 p90 -158.42 -178.83 7.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.066 0.46 . . . . 73.23 111.684 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -136.86 140.37 42.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.746 -0.661 . . . . 73.31 110.601 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.4 t -123.93 152.23 29.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.108 0.48 . . . . 74.23 111.913 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -136.64 109.78 7.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.635 -0.711 . . . . 74.32 110.289 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . 0.412 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.8 128.7 37.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.401 -0.363 . . . . 73.54 110.776 -179.681 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.42 -32.51 2.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.21 -0.45 . . . . 73.34 111.516 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -169.37 159.78 8.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.866 0.365 . . . . 70.14 111.077 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 3.4 mp -140.83 110.31 3.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.046 -0.524 . . . . 72.15 111.077 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.421 . . . . 54.33 110.916 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 mtt . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.752 0.31 . . . . 73.43 111.171 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.97 99.67 2.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 73.4 111.186 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -98.31 178.07 5.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 75.52 111.031 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 165.97 85.61 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.251 -0.432 . . . . 73.34 111.172 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.4 t -89.31 110.8 41.29 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.466 -0.334 . . . . 54.25 110.642 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.453 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 87.1 Cg_endo -79.04 136.08 12.78 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.61 2.207 . . . . 75.23 112.582 -179.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -78.81 157.44 28.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 74.4 110.882 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.91 95.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 74.35 111.171 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.05 -18.0 63.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.489 . . . . 65.23 111.436 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.413 ' CD1' HD12 ' A' ' 20' ' ' LEU . 1.3 m-90 -137.2 173.74 11.36 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.94 0.4 . . . . 73.34 110.897 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.9 m -115.46 150.17 36.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.976 -0.556 . . . . 75.21 110.642 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.5 t -56.66 -31.79 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.917 0.389 . . . . 72.03 110.621 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -77.09 -25.56 52.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.968 -0.56 . . . . 73.31 111.042 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -82.21 -58.09 3.1 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.856 0.36 . . . . 75.33 110.833 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 mt -50.53 -61.08 2.4 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.196 -0.456 . . . . 73.13 111.004 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 22.3 mtt180 -54.16 -24.0 16.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.092 -0.504 . . . . 74.1 111.207 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.81 176.11 0.22 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.936 0.398 . . . . 73.52 111.115 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -110.3 16.65 21.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.022 -0.536 . . . . 73.24 111.161 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -106.9 -25.62 11.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.564 -0.289 . . . . 74.13 111.068 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.413 HD12 ' CD1' ' A' ' 10' ' ' TRP . 2.5 tt -88.05 112.69 50.95 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.413 -0.358 . . . . 74.35 110.957 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.37 125.46 18.99 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.433 2.088 . . . . 75.34 112.368 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.5 -24.12 66.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.162 -0.472 . . . . 75.22 111.156 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.0 -40.01 66.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.393 -0.367 . . . . 72.54 111.343 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.52 -56.79 5.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.219 -0.446 . . . . 75.53 111.063 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.9 mt -44.82 -31.37 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.88 -0.6 . . . . 75.42 111.446 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.7 mt -76.81 -38.8 30.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.931 0.396 . . . . 75.12 110.98 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -72.92 -24.67 60.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.988 -0.551 . . . . 75.31 111.075 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -71.46 -46.83 58.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.035 0.445 . . . . 74.32 110.812 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.4 mt -67.77 -25.03 65.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.838 -0.619 . . . . 72.33 110.994 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -78.55 -24.52 45.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.249 -0.432 . . . . 54.51 111.09 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.426 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 10.6 pt-20 -93.92 -41.29 9.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.808 0.337 . . . . 73.03 110.838 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.453 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 35.6 m170 -97.28 16.59 19.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 72.12 110.955 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.95 153.7 23.42 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.795 -0.717 . . . . 72.43 112.507 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.7 p -90.62 152.96 20.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.628 0.252 . . . . 72.32 110.507 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -49.32 -57.05 7.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.691 0.281 . . . . 71.21 111.116 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.8 t -47.95 -50.68 26.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.009 0.433 . . . . 65.14 110.685 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.458 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 9.0 t80 -53.56 -47.16 70.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.78 -0.646 . . . . 65.12 110.348 179.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.405 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 12.9 mt -66.29 -41.04 90.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.047 -0.524 . . . . 74.44 110.722 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.427 ' CB ' HD21 ' A' ' 44' ' ' LEU . . . -48.26 -45.56 34.66 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.028 0.442 . . . . 73.21 110.943 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -58.43 -27.29 64.2 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.722 -0.672 . . . . 73.44 110.78 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -112.74 11.88 19.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.207 -0.451 . . . . 75.44 111.124 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.9 mptt 51.22 33.61 9.9 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.85 0.357 . . . . 71.41 110.907 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 46.7 mt -91.35 -22.62 20.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.104 -0.498 . . . . 75.43 111.802 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.427 HD21 ' CB ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -77.37 157.98 30.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.018 0.437 . . . . 74.1 111.123 -179.73 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.73 -121.21 5.1 Favored Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 115.807 -0.633 . . . . 71.35 112.446 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -116.32 116.29 27.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.746 0.308 . . . . 74.31 110.914 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mp -45.74 -55.83 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.24 -0.437 . . . . 72.55 111.413 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -47.61 -37.88 13.45 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.86 -0.609 . . . . 71.52 111.022 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -85.7 -26.08 26.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.022 -0.536 . . . . 72.03 111.089 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 23.7 t -81.2 -25.8 10.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 75.44 111.418 -179.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.1 -15.63 63.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.381 -0.372 . . . . 70.22 111.15 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -95.14 -32.96 12.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.235 -0.439 . . . . 73.54 110.86 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -87.94 -29.67 20.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.22 -0.446 . . . . 73.24 111.042 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -96.2 125.55 40.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.301 -0.409 . . . . 71.52 111.1 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -81.2 175.14 10.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 74.31 110.588 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.98 -58.25 9.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.855 0.36 . . . . 75.55 110.552 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.9 -26.46 68.61 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.075 -0.512 . . . . 65.51 110.584 179.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.0 -44.23 97.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.094 0.473 . . . . 74.25 110.441 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 19.2 mt -71.23 -33.68 70.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.635 -0.711 . . . . 75.45 111.046 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 16.4 t -77.38 -42.2 30.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.295 -0.411 . . . . 75.42 110.802 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.4 m -59.61 -34.6 72.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.866 -0.606 . . . . 75.53 110.634 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.96 -21.5 37.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 65.51 111.074 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -82.84 -22.89 33.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 74.32 111.029 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -84.37 -53.74 5.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.331 -0.395 . . . . 75.34 111.507 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.458 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.6 p-80 -61.08 -33.09 72.8 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.125 -0.489 . . . . 73.22 111.257 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.434 HD22 ' CD2' ' A' ' 72' ' ' PHE . 5.3 tt -47.64 -40.24 19.22 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.962 0.41 . . . . 72.21 111.258 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.406 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.7 m-85 -77.8 -39.02 45.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.029 -0.532 . . . . 75.43 110.679 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -36.28 81.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.92 -0.582 . . . . 73.54 110.988 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.5 p -93.64 -6.65 45.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 71.34 111.475 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.18 36.45 15.81 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.71 0.29 . . . . 73.22 111.186 179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -93.97 44.07 1.12 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.363 -0.381 . . . . 73.13 110.979 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.434 ' CD2' HD22 ' A' ' 66' ' ' LEU . 87.8 m-85 -65.48 174.65 2.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 74.44 110.822 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.2 tttt -70.07 153.07 43.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.274 -0.421 . . . . 74.23 110.906 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -103.15 -85.8 1.9 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.705 -0.759 . . . . 73.41 112.424 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.5 m -163.97 157.78 18.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.788 0.328 . . . . 73.03 110.848 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -169.03 -42.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 64.34 110.986 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 83.6 p -156.07 179.76 8.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.117 -0.492 . . . . 72.41 111.017 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 24.8 mm -140.8 135.34 33.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 72.24 111.138 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.3 m -93.47 159.78 15.09 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.239 -0.437 . . . . 71.12 110.886 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -162.63 143.58 9.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 74.11 110.862 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.2 m -126.81 173.46 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 71.24 111.159 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.3 t -104.27 105.16 15.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.451 . . . . 60.13 110.858 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -149.98 151.59 33.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 75.34 110.913 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -152.6 144.23 23.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 75.43 110.954 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -131.7 127.37 58.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 74.52 111.138 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -129.03 -60.89 1.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 71.23 110.891 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -145.71 118.69 8.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 74.53 110.899 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.81 152.55 26.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 72.22 111.109 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.5 tptt -91.23 -33.06 15.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.206 -0.452 . . . . 74.03 110.866 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.5 tp 60.31 102.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.453 . . . . 74.4 110.886 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -106.08 -32.87 8.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 64.34 110.871 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -133.3 152.58 51.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 73.43 110.883 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -98.76 134.89 41.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 63.31 110.9 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 22.8 mtmt -131.76 161.26 63.51 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 75.42 110.926 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -69.89 163.54 37.98 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.553 2.168 . . . . 75.31 112.36 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.51 171.56 4.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 75.41 110.884 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -177.7 -39.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 74.14 110.957 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.0 t -93.44 136.41 33.73 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.09 -0.504 . . . . 74.01 110.895 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.48 147.56 39.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.181 -0.463 . . . . 73.41 110.864 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.4 p -86.33 126.58 34.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 75.23 110.902 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.23 31.52 2.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 71.44 110.91 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -108.36 126.68 53.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 72.11 110.901 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 71.8 p -109.82 143.15 40.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 52.44 110.914 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 7.9 mt -80.05 -179.07 6.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 64.44 110.906 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -112.37 -35.54 5.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 63.25 110.93 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.86 -38.1 3.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.126 -0.488 . . . . 74.11 110.946 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.03 91.7 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.745 -0.74 . . . . 73.04 112.523 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.51 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 32.0 Cg_exo -56.77 -46.07 32.13 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.539 2.16 . . . . 74.54 112.902 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.51 ' CD ' ' N ' ' A' ' 108' ' ' PRO . 90.1 Cg_endo -82.01 -168.12 0.57 Allowed 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 123.007 2.471 . . . . 75.42 112.381 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.426 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -140.69 28.82 1.95 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.235 -0.438 . . . . 75.04 110.959 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 8.0 p90 -154.34 147.9 25.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.278 -0.419 . . . . 73.02 110.882 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 70.7 m -118.01 103.55 10.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 71.02 110.893 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.61 151.46 21.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.331 -0.395 . . . . 73.52 111.117 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.2 m -143.93 124.96 14.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.114 -0.494 . . . . 73.43 110.761 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 10.0 p -82.61 108.62 15.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.234 -0.439 . . . . 74.44 111.193 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -84.55 -47.86 10.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 75.32 110.784 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -117.63 107.9 14.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.177 -0.465 . . . . 75.32 110.949 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -62.15 134.35 56.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 75.31 110.917 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -104.52 -160.99 24.13 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.78 -0.724 . . . . 74.44 112.319 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -34.84 -47.33 0.34 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.917 0.389 . . . . 73.25 111.723 -179.411 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 72.44 37.59 0.9 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.945 -0.57 . . . . 74.24 110.484 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -162.08 -44.05 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.921 -0.581 . . . . 73.51 110.758 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -85.62 97.28 10.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 60.35 110.889 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -112.27 155.21 43.93 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.101 -0.499 . . . . 74.21 110.819 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -73.84 125.52 10.0 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.529 2.152 . . . . 75.23 112.57 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -96.07 160.16 14.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.005 -0.543 . . . . 75.33 110.913 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.74 116.12 2.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.234 -0.439 . . . . 75.13 110.981 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 101.08 -28.28 16.74 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.743 -0.742 . . . . 64.43 112.239 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -71.68 130.96 42.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.703 0.287 . . . . 75.04 110.4 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.519 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 12.4 m -73.59 176.17 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.072 0.463 . . . . 74.12 111.423 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.598 ' O ' ' HA ' ' A' ' 163' ' ' SER . 19.9 m -156.99 146.27 11.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.567 -0.742 . . . . 74.33 110.655 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.409 ' ND1' ' HB3' ' A' ' 163' ' ' SER . 0.5 OUTLIER -124.61 117.27 23.91 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.987 -0.285 . . . . 74.33 110.405 179.275 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.434 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 29.7 p -155.38 169.96 23.01 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.075 0.464 . . . . 61.51 111.411 -179.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.426 ' CE3' HG13 ' A' ' 149' ' ' ILE . 60.7 m95 -102.26 160.45 14.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.735 -0.666 . . . . 72.11 110.234 179.369 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -158.25 134.64 9.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.977 0.418 . . . . 73.25 111.59 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 84.8 m -124.84 108.83 12.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.616 . . . . 74.3 110.174 179.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.6 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -93.76 143.7 16.67 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.594 -0.812 . . . . 73.32 113.38 -179.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -152.36 134.28 14.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.718 0.294 . . . . 72.21 110.574 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 52.9 mt -62.15 -179.73 0.24 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.425 -0.352 . . . . 72.42 110.672 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -54.74 -41.69 70.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.914 0.387 . . . . 73.22 110.836 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -80.68 0.35 34.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.016 -0.538 . . . . 72.2 111.488 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.19 25.85 27.66 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.644 -0.789 . . . . 60.35 112.542 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.8 m -80.77 108.34 14.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.828 0.347 . . . . 64.23 110.943 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 38.3 t -63.81 120.45 10.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 74.04 111.102 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.428 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 21.5 p90 -111.61 -24.43 10.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.222 -0.444 . . . . 70.25 111.104 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -162.18 112.63 1.56 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.799 0.333 . . . . 64.44 111.149 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 43.5 m -127.01 113.28 16.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 75.4 110.696 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -87.1 12.64 11.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 74.54 111.66 -179.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.449 ' CD1' ' N ' ' A' ' 149' ' ' ILE . 2.5 mp -114.13 119.59 61.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.857 0.361 . . . . 75.21 111.003 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -123.57 -48.47 1.93 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 74.51 110.858 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 29.8 p -146.48 166.0 27.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 73.5 110.954 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.3 m -83.31 166.3 18.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 75.2 110.953 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.06 -47.28 13.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.439 . . . . 73.21 111.071 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.9 tppt? -60.06 -33.08 71.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 74.23 110.943 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 12.4 tttp -76.54 -31.59 57.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.172 -0.467 . . . . 74.43 110.88 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -173.11 166.35 4.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 74.21 110.916 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 28.3 mttt -98.79 31.27 3.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 75.11 110.896 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -101.26 34.46 2.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 74.3 110.853 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.18 118.43 3.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 73.33 111.034 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.1 mttt -132.53 124.32 18.97 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 75.55 110.874 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.98 150.51 30.58 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.493 2.129 . . . . 71.43 112.294 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.417 HD22 ' CD1' ' A' ' 164' ' ' PHE . 0.5 OUTLIER -80.17 128.85 34.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.199 -0.455 . . . . 74.31 110.658 179.909 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.598 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 1.0 OUTLIER -109.45 127.3 54.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.322 -0.399 . . . . 65.55 111.313 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . 0.417 ' CD1' HD22 ' A' ' 162' ' ' LEU . 25.3 p90 -152.82 143.5 22.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.066 -0.516 . . . . 74.51 110.829 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.519 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 2.2 mptt -71.02 132.34 45.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.337 -0.392 . . . . 74.23 110.9 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.7 m -87.68 149.26 4.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.142 -0.481 . . . . 64.51 111.06 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.74 24.46 75.47 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.792 -0.718 . . . . 44.4 112.64 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 14.4 m -134.03 46.42 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.845 0.355 . . . . 74.33 111.129 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.28 35.74 2.73 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 121.204 -0.522 . . . . 70.12 113.256 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt -81.19 -47.03 13.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.897 0.38 . . . . 75.13 110.952 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . 0.406 HG13 ' CE3' ' A' ' 175' ' ' TRP . 0.3 OUTLIER -118.64 -179.09 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.992 -0.549 . . . . 65.41 110.879 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.535 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.4 pt -57.8 158.85 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.418 -0.355 . . . . 71.43 111.074 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 25.5 ttm105 -67.45 -27.15 66.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.235 -0.439 . . . . 73.23 111.273 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.58 -36.65 37.43 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.679 -0.772 . . . . 74.12 112.188 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.535 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 1.9 t90 -77.86 -33.68 52.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.954 0.407 . . . . 72.0 111.014 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -62.27 -41.54 98.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.964 -0.562 . . . . 72.53 110.308 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.94 -29.78 65.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.9 -0.591 . . . . 71.43 110.547 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -78.7 -61.65 1.94 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 71.41 111.246 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.487 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 15.1 mt -58.9 -20.44 51.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.978 -0.556 . . . . 73.41 111.23 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 4.1 mt -60.37 -27.21 67.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.774 0.321 . . . . 75.43 110.883 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 69.9 p -107.78 10.27 28.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 73.41 111.598 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.35 99.41 2.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.87 0.367 . . . . 64.43 110.848 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.17 161.46 19.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 75.32 111.169 -179.557 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 10.8 tttt -59.88 114.99 3.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.827 -0.624 . . . . 74.52 111.227 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 81.3 8.62 86.97 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.961 -0.638 . . . . 72.33 113.126 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -85.4 139.7 31.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.028 0.442 . . . . 74.4 111.404 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -117.08 139.28 50.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.861 -0.609 . . . . 74.23 109.927 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -148.01 175.39 11.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 73.02 112.061 -179.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.63 121.39 17.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.41 -0.813 . . . . 72.13 109.56 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -134.36 143.42 47.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.346 0.593 . . . . 65.41 112.351 -178.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . 0.4 ' HG2' ' CG2' ' A' ' 215' ' ' THR . 4.2 mt-10 -114.87 117.42 30.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.135 -0.939 . . . . 71.44 109.945 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.449 ' CD1' ' CZ ' ' A' ' 216' ' ' PHE . 2.2 mt -108.28 137.15 41.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.972 0.415 . . . . 71.02 111.495 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.63 164.94 45.89 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 70.35 110.57 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . 0.433 ' HG3' ' HA ' ' A' ' 211' ' ' ASN . 19.4 Cg_endo -59.03 -35.24 98.79 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.568 2.179 . . . . 75.25 112.226 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -56.54 -43.53 79.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 50.41 111.411 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . 0.426 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 12.5 m0 -96.64 34.96 1.57 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.884 0.373 . . . . 72.32 111.169 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -159.38 -78.78 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.004 -0.544 . . . . 72.1 110.727 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.442 ' CE2' ' CD1' ' A' ' 208' ' ' ILE . 47.1 m-85 -105.47 -71.28 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.0 0.429 . . . . 73.23 110.401 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.23 178.4 16.43 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.763 -0.732 . . . . 71.22 112.953 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -56.98 -31.7 65.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.811 0.339 . . . . 71.3 110.803 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -53.3 58.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.464 . . . . 75.23 110.609 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 107.61 -147.3 16.35 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.845 -0.693 . . . . 63.11 112.518 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . 0.418 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.0 OUTLIER -156.61 82.9 3.29 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.779 0.323 . . . . 73.51 110.656 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -51.13 -35.7 52.66 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.749 2.3 . . . . 73.44 112.638 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.7 -42.1 83.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.855 0.359 . . . . 74.45 111.009 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -101.77 27.17 6.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.052 -0.522 . . . . 74.35 111.361 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 51.7 31.04 7.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.366 -0.379 . . . . 74.3 111.09 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . 0.442 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 24.5 mt -89.17 111.71 46.77 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 72.11 111.181 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -74.5 164.85 33.0 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.451 2.101 . . . . 71.32 112.397 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.99 147.89 50.36 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.651 2.234 . . . . 74.33 112.347 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . 0.433 ' HA ' ' HG3' ' A' ' 194' ' ' PRO . 70.7 m-80 51.13 36.22 15.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 73.12 111.03 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -82.58 142.14 32.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 74.12 111.978 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -97.24 159.2 15.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.677 -0.692 . . . . 73.14 109.873 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.41 HD13 ' CE2' ' A' ' 198' ' ' TYR . 3.0 mt -134.39 108.99 8.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.988 0.423 . . . . 74.43 111.951 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 215' ' ' THR . . . . . 0.4 ' CG2' ' HG2' ' A' ' 191' ' ' GLU . 25.5 m -103.06 139.68 38.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.873 -0.603 . . . . 75.02 110.449 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.6 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 12.4 p90 -158.75 179.27 9.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.097 0.475 . . . . 70.11 111.894 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -136.67 140.32 42.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.543 -0.753 . . . . 74.42 110.593 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 4.4 t -124.12 151.8 29.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.087 0.47 . . . . 72.33 111.986 -178.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -135.97 109.21 7.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.608 -0.724 . . . . 74.21 110.106 179.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . 0.434 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.71 127.89 34.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.313 -0.403 . . . . 71.04 110.936 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 22.0 t -109.06 -29.46 2.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.167 -0.469 . . . . 63.4 111.33 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -169.59 160.34 8.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.412 -0.358 . . . . 65.41 110.916 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 3.4 mp -139.24 110.17 4.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 74.25 111.106 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 75.54 110.892 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 mtt . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.856 0.36 . . . . 71.34 111.211 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -108.3 136.93 47.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 75.22 111.121 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -95.24 78.24 3.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 73.0 111.103 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -74.74 170.29 16.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 73.34 111.08 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 24.0 t -65.24 111.77 6.78 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 73.44 111.165 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.449 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.5 Cg_endo -78.4 137.61 15.02 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.608 2.206 . . . . 71.33 112.419 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.402 ' O ' ' N ' ' A' ' 9' ' ' ALA . 7.6 mm-40 -80.2 154.72 27.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.246 -0.433 . . . . 71.41 110.852 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.34 89.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.107 -0.497 . . . . 72.45 111.373 -179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.402 ' N ' ' O ' ' A' ' 7' ' ' GLN . . . -60.69 -34.55 74.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 73.04 111.056 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.417 ' CD1' HD12 ' A' ' 20' ' ' LEU . 1.5 m-90 -116.09 173.74 6.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.489 . . . . 72.53 110.965 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.3 m -116.25 152.18 34.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.944 -0.571 . . . . 65.51 110.535 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t -56.6 -33.64 40.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.912 0.386 . . . . 72.02 110.854 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -74.13 -25.7 59.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.989 -0.55 . . . . 74.21 111.181 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -82.12 -56.91 3.65 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.806 0.336 . . . . 73.44 110.994 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mt -49.6 -63.73 1.02 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.258 -0.428 . . . . 73.45 111.116 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 22.5 mtt180 -53.92 -24.72 17.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.484 . . . . 74.51 111.187 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.17 178.23 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.034 0.445 . . . . 74.43 111.256 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -110.41 17.05 21.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.827 -0.624 . . . . 74.22 111.179 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.67 -24.89 11.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.588 -0.278 . . . . 73.44 111.231 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.417 HD12 ' CD1' ' A' ' 10' ' ' TRP . 6.2 tt -89.07 116.27 65.88 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.414 -0.357 . . . . 74.44 111.054 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.29 124.41 15.81 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.437 2.091 . . . . 73.32 112.235 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -24.18 65.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 74.24 111.206 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -57.75 -32.97 67.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.388 -0.369 . . . . 74.42 111.335 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -78.87 -53.07 7.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.923 0.392 . . . . 73.22 111.133 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 34.9 mt -46.54 -35.66 2.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.899 -0.592 . . . . 71.42 111.411 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 6.2 mt -75.74 -44.72 39.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 74.52 111.012 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.78 -25.18 64.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.01 -0.541 . . . . 74.33 110.925 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 38.3 t80 -70.05 -44.01 70.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 74.21 110.65 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.5 mt -71.32 -24.21 62.08 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.752 -0.658 . . . . 75.2 110.92 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -76.34 -25.15 54.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.282 -0.417 . . . . 74.21 110.803 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -102.35 -10.51 19.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.236 -0.438 . . . . 73.41 111.095 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 13.1 m170 -117.09 -11.43 10.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.425 -0.352 . . . . 72.22 111.371 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -120.3 164.69 13.8 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.679 -0.772 . . . . 62.21 112.391 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.77 149.58 21.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.599 0.238 . . . . 73.12 110.468 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -48.51 -57.15 6.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.79 0.328 . . . . 62.35 111.016 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.3 p -47.89 -51.67 22.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.909 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.516 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 4.7 t80 -53.48 -46.85 70.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.835 -0.621 . . . . 72.12 110.387 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 13.2 mt -65.34 -41.47 93.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.0 -0.545 . . . . 71.04 110.744 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.11 -43.64 31.21 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.961 0.41 . . . . 74.14 111.034 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -58.87 -27.96 65.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.905 -0.589 . . . . 63.53 110.834 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 39.1 m-70 -112.75 10.28 19.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.155 -0.475 . . . . 71.32 111.169 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.4 mttp 55.24 36.98 28.2 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.89 0.376 . . . . 63.01 110.823 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.7 mt -94.97 -21.84 18.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.109 -0.496 . . . . 72.33 111.898 -179.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.24 155.51 32.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.12 0.486 . . . . 75.23 111.201 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.27 -123.51 5.89 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.626 -0.715 . . . . 75.34 112.427 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -116.38 118.04 31.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.75 0.309 . . . . 73.4 110.986 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.1 mp -45.16 -52.22 2.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.167 -0.47 . . . . 70.3 111.401 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -47.34 -37.16 10.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.907 -0.588 . . . . 73.43 110.974 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -85.65 -25.67 26.45 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.921 -0.581 . . . . 73.24 111.205 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.5 t -83.45 -25.94 7.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.384 -0.371 . . . . 73.52 111.453 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.78 -17.93 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.441 -0.345 . . . . 72.04 111.406 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.6 pttp -95.09 -33.8 12.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.829 0.347 . . . . 75.13 110.995 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.5 m -87.38 -31.0 20.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.228 -0.442 . . . . 75.33 111.031 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.68 127.7 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 71.13 111.17 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -83.41 176.77 8.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 73.42 110.683 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.54 -58.25 9.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.869 0.366 . . . . 73.34 110.515 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.39 -29.49 70.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.141 -0.481 . . . . 74.54 110.308 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -42.22 98.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 74.41 110.435 179.645 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 71.8 mt -72.03 -35.75 69.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.734 -0.666 . . . . 74.52 110.87 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 17.3 t -75.57 -41.24 41.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.213 -0.449 . . . . 74.51 110.826 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.6 m -60.45 -34.0 73.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.895 -0.593 . . . . 52.44 110.428 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.409 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -80.7 -21.24 41.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 72.53 110.932 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -83.86 -22.95 31.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.077 -0.51 . . . . 74.44 111.017 179.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -84.89 -54.51 4.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.23 -0.441 . . . . 73.34 111.512 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.516 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.4 p-80 -61.31 -26.28 67.68 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.076 -0.511 . . . . 75.03 111.056 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.435 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.7 tt -53.08 -39.81 63.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.938 0.399 . . . . 74.2 110.976 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -78.23 -37.66 44.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.981 -0.554 . . . . 74.2 110.599 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.62 -36.51 78.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.974 -0.557 . . . . 72.52 110.818 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 46.6 p -88.9 -9.82 50.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.033 -0.531 . . . . 75.21 111.454 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 50.5 37.69 16.53 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.754 0.312 . . . . 70.1 111.234 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 37.1 mtt180 -100.3 47.54 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.286 -0.416 . . . . 75.35 110.975 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.426 ' CD2' ' HD2' ' A' ' 6' ' ' PRO . 75.1 m-85 -69.22 178.61 2.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.164 -0.471 . . . . 74.23 110.924 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -76.59 132.02 39.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 74.12 110.749 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 179.91 -84.96 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.647 -0.787 . . . . 72.51 112.479 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 26.8 p -57.13 96.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.82 0.343 . . . . 73.02 110.981 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -176.98 -39.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 53.04 110.88 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 68.8 m -160.8 120.11 2.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.116 -0.493 . . . . 72.44 110.927 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.2 mt -103.81 -30.47 2.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.464 . . . . 72.24 111.148 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.1 m -157.27 -45.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 74.14 110.963 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.1 mtpt 61.32 113.82 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.997 -0.547 . . . . 75.14 110.92 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.4 m -123.71 114.58 42.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.457 . . . . 71.22 111.091 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 37.0 m -92.57 172.38 8.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 73.23 110.874 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -107.9 -33.02 7.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 73.42 110.928 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -164.31 96.31 0.77 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 65.13 110.886 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.6 t -131.12 113.24 23.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 72.31 111.146 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.42 120.68 13.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 74.03 110.921 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -137.94 29.38 2.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 64.44 110.957 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 20.8 t 68.79 -67.99 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.25 -0.432 . . . . 73.32 111.285 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -64.57 98.09 0.24 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.982 -0.554 . . . . 73.34 110.939 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 61.79 152.02 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 75.33 110.933 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 20.2 p-10 -112.78 -34.61 5.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 65.32 110.927 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 60.4 100.75 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.858 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -111.57 -33.22 6.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.448 . . . . 74.42 110.979 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.4 mmtt -93.49 143.03 25.98 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 74.24 110.939 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.32 132.42 50.63 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.501 2.134 . . . . 64.42 112.269 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -177.21 116.06 0.1 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.464 . . . . 63.42 110.89 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -151.25 130.38 12.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 73.13 110.917 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.8 t -150.6 110.32 4.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.175 -0.466 . . . . 74.41 110.882 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.34 137.72 44.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 65.32 110.918 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 43.0 m -140.45 163.64 32.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 72.4 110.919 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.64 106.36 7.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 71.24 110.937 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -160.58 124.57 3.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 73.31 110.899 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 53.8 p -157.5 137.33 12.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 75.13 110.871 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 tt 61.26 113.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 74.01 110.965 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.6 -33.21 11.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 73.43 110.924 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -95.6 89.92 5.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 74.04 110.876 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -127.6 92.5 0.36 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.739 -0.743 . . . . 74.55 112.482 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.513 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 32.1 Cg_exo -56.58 -45.95 33.39 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.54 2.16 . . . . 75.12 112.904 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.513 ' CD ' ' N ' ' A' ' 108' ' ' PRO . 89.5 Cg_endo -81.99 -168.09 0.57 Allowed 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 123.019 2.479 . . . . 75.43 112.389 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.414 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -131.46 30.24 4.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 74.44 110.936 -180.0 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.409 ' CE2' ' HB3' ' A' ' 178' ' ' ALA . 41.4 p90 -151.59 155.08 37.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.273 -0.421 . . . . 71.35 110.931 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 71.5 m -122.88 103.5 8.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.161 -0.472 . . . . 71.21 110.845 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . 0.405 ' HG3' ' HB3' ' A' ' 190' ' ' LEU . 0.0 OUTLIER -89.48 151.38 22.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.275 -0.421 . . . . 64.21 111.125 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -144.89 112.83 6.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 75.43 110.837 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 19.5 t -81.94 106.36 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 74.1 111.29 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -83.21 -41.81 17.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 72.22 110.844 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 4.6 tptt -128.44 108.13 10.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 73.12 110.984 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -59.44 144.67 46.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 72.02 110.966 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.507 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -115.66 -156.55 11.03 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.721 -0.752 . . . . 64.32 112.642 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -35.84 -52.32 0.72 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.022 0.439 . . . . 74.53 111.576 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.9 tttp 69.9 33.47 2.82 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.834 -0.621 . . . . 74.15 110.325 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -152.33 -44.57 0.1 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.796 -0.638 . . . . 73.3 110.651 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -91.01 98.41 11.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 74.31 110.841 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -108.08 157.16 36.91 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 71.42 110.913 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.93 125.83 11.34 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.577 2.185 . . . . 74.25 112.407 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -96.88 155.08 16.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 74.44 110.889 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -62.69 117.12 5.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 75.14 110.861 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 104.78 -22.96 32.43 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.612 -0.804 . . . . 74.34 112.647 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -85.95 140.17 30.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.756 0.312 . . . . 75.31 110.818 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.532 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 22.2 m -69.09 173.24 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.971 0.415 . . . . 71.43 111.328 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.666 ' O ' ' HA ' ' A' ' 163' ' ' SER . 15.9 m -156.89 145.77 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.717 -0.674 . . . . 62.53 110.588 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.461 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.95 117.89 22.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.659 0.266 . . . . 75.01 110.665 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 25.1 p -150.28 173.92 13.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.118 0.485 . . . . 73.03 111.407 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.461 ' HB3' ' CD1' ' A' ' 149' ' ' ILE . 87.5 m95 -108.25 157.58 18.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.552 -0.749 . . . . 75.23 110.057 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.452 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 40.3 p90 -162.23 138.37 7.67 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.223 0.535 . . . . 73.23 112.145 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 12.3 m -129.69 114.57 16.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.426 -0.806 . . . . 71.04 110.151 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.589 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.06 146.01 18.11 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.544 -0.836 . . . . 70.42 113.328 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.22 147.8 27.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.816 0.341 . . . . 75.5 110.766 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 12.6 mt -81.72 -177.18 6.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 74.43 110.851 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -59.66 -43.1 94.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.45 . . . . 74.52 110.885 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.04 -5.73 56.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.981 -0.554 . . . . 72.44 111.357 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 98.44 25.42 10.11 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.7 -0.762 . . . . 42.44 112.648 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.08 109.65 20.69 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.827 0.346 . . . . 71.01 110.761 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . 0.406 ' HA ' ' O ' ' A' ' 137' ' ' GLY . 3.0 m -63.69 135.1 28.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.446 . . . . 72.53 111.296 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.437 ' CD1' ' N ' ' A' ' 146' ' ' ASP . 21.0 p90 -116.85 -40.99 3.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.094 -0.503 . . . . 64.25 110.643 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . 0.437 ' N ' ' CD1' ' A' ' 145' ' ' PHE . 70.6 m-20 -143.65 110.3 5.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.914 -0.584 . . . . 71.11 110.374 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 25.0 m -134.1 107.72 7.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.941 0.401 . . . . 75.23 111.455 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . 0.452 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 27.8 t30 -90.32 44.3 1.19 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.958 -0.565 . . . . 70.14 110.21 179.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.461 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 35.5 mm -122.92 105.39 15.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 62.01 110.893 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -95.73 -77.92 0.47 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 75.22 110.938 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 48.6 p -146.49 166.03 27.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 71.54 110.937 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 40.4 m -78.24 139.09 38.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.224 -0.444 . . . . 74.32 110.886 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -67.61 -30.89 70.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.227 -0.442 . . . . 65.33 111.122 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.25 -33.1 71.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 74.24 110.912 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.07 -63.1 1.5 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 74.32 110.943 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 13.0 tttm -138.53 135.57 35.2 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.881 -0.599 . . . . 75.44 110.931 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 8.6 mttm -69.15 93.92 0.64 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.441 . . . . 65.34 110.934 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -176.49 46.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 73.52 110.85 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.09 125.8 5.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 74.03 111.075 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 13.5 mmtt -140.8 145.97 42.12 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 74.34 110.897 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -69.71 152.93 69.68 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.549 2.166 . . . . 60.44 112.31 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 2.0 tt -73.67 123.09 23.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 74.54 110.48 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.666 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.39 120.83 40.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.939 0.4 . . . . 75.43 111.266 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 13.9 p90 -149.67 141.13 23.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.029 -0.532 . . . . 74.44 110.786 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.532 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 28.2 mtmt -77.34 138.17 39.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.958 0.409 . . . . 72.1 110.895 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 29.8 m -87.5 148.92 4.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.945 -0.57 . . . . 73.42 111.051 -179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 66.01 25.59 72.11 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.688 -0.768 . . . . 73.23 112.098 -179.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 1.9 t -130.98 40.98 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.843 0.354 . . . . 74.31 111.016 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.54 35.18 5.38 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 121.05 -0.595 . . . . 72.41 112.966 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.31 -47.05 11.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.906 0.384 . . . . 73.05 111.064 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.3 m -117.48 179.73 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.095 -0.502 . . . . 73.21 111.058 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.493 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -59.95 160.11 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.332 -0.394 . . . . 71.14 111.12 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -68.04 -28.89 67.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.264 -0.426 . . . . 74.45 111.193 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.83 -37.82 43.6 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.64 -0.79 . . . . 74.14 111.943 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.493 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.3 t90 -79.03 -34.06 44.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.043 0.449 . . . . 73.11 110.964 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -65.16 -31.16 72.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.756 -0.656 . . . . 74.12 110.602 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -82.0 -28.53 32.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 75.14 110.833 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . 0.409 ' HB3' ' CE2' ' A' ' 111' ' ' TYR . . . -80.32 -62.01 1.81 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.226 -0.443 . . . . 71.04 111.168 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.477 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 6.4 mt -50.29 -32.56 17.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.972 -0.558 . . . . 75.32 110.824 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.54 -24.58 21.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.138 -0.483 . . . . 74.41 110.957 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 24.9 p -97.54 1.84 49.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.253 -0.431 . . . . 65.44 111.707 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.68 152.77 29.75 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.765 0.316 . . . . 64.41 110.565 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 10.3 p -120.94 173.07 7.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.977 0.418 . . . . 74.5 111.505 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.61 117.4 7.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.808 -0.633 . . . . 74.05 110.574 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.43 66.46 2.24 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.614 -0.803 . . . . 53.54 112.085 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . 0.507 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 30.9 tt0 -145.05 144.4 30.96 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.623 0.249 . . . . 74.54 110.461 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -119.26 137.24 53.8 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.204 -0.295 . . . . 72.53 110.204 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -144.26 173.1 12.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.149 0.499 . . . . 75.03 111.865 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.57 101.14 4.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.527 -0.761 . . . . 65.54 109.752 179.413 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.428 ' HG ' ' CE1' ' A' ' 216' ' ' PHE . 1.0 OUTLIER -115.61 142.26 46.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.123 0.487 . . . . 74.45 111.947 -178.827 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -114.14 119.28 36.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.651 -0.704 . . . . 74.25 110.207 179.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.414 HG12 ' CE2' ' A' ' 216' ' ' PHE . 1.8 mm -99.51 143.93 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.858 0.361 . . . . 72.15 111.262 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.42 165.4 46.54 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.075 -0.512 . . . . 71.44 110.602 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -64.51 -43.57 13.32 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.486 2.124 . . . . 72.44 112.264 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -54.67 -24.28 21.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 73.54 111.304 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . 0.414 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 8.5 m0 -115.93 36.94 3.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.404 -0.362 . . . . 75.4 111.122 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -156.67 -81.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.259 -0.428 . . . . 61.42 111.363 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.453 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 17.2 m-85 -104.76 -31.19 9.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.899 0.381 . . . . 70.23 110.937 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 107.25 168.42 22.09 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.747 -0.74 . . . . 73.22 112.575 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -30.62 67.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.846 0.355 . . . . 72.33 110.896 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 6.8 pttt -59.91 -48.12 83.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.245 -0.434 . . . . 74.02 110.754 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.68 161.78 24.08 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.801 -0.714 . . . . 74.32 112.467 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . 0.428 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.3 OUTLIER -105.77 89.1 3.27 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 120.65 0.262 . . . . 75.11 110.809 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.37 -22.25 52.83 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.502 2.134 . . . . 64.51 112.369 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.3 -40.51 82.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.304 -0.407 . . . . 73.14 110.923 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -109.26 27.13 9.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 73.44 111.254 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 11.0 tttt 56.84 54.4 7.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.249 -0.432 . . . . 74.31 111.044 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . 0.434 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 42.4 mt -118.36 111.68 38.13 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 74.42 111.125 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.37 172.54 1.86 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.516 2.144 . . . . 75.23 112.309 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.2 127.53 12.09 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.583 2.188 . . . . 74.11 112.332 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 30.3 m-20 63.9 71.23 0.49 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.277 -0.419 . . . . 74.53 110.852 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.84 128.59 49.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 54.43 111.248 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -65.59 141.37 58.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.477 . . . . 74.12 110.735 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.453 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 22.8 mt -121.79 109.61 14.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 74.4 111.117 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.95 136.83 46.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.36 -0.382 . . . . 72.33 110.778 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.589 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 18.0 p90 -152.92 176.94 11.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.992 0.425 . . . . 74.5 111.268 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -130.92 135.0 47.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.843 -0.617 . . . . 75.22 110.31 179.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 2.6 t -120.24 150.13 22.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.076 0.465 . . . . 64.21 112.122 -178.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -136.75 107.63 6.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.617 -0.72 . . . . 75.41 110.192 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 3.0 tt -70.37 134.47 47.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.38 -0.373 . . . . 73.53 111.046 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 20.9 t -111.3 -29.81 2.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.207 -0.451 . . . . 75.03 111.446 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -173.0 163.87 4.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.855 0.359 . . . . 74.51 111.112 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 2.7 mp -139.86 110.42 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 74.13 110.984 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 74.13 110.836 179.87 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.846 0.355 . . . . 73.21 111.181 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -174.89 89.21 0.05 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 75.15 111.097 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -73.14 86.89 1.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 64.1 111.107 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.29 142.86 41.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 71.4 111.202 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.411 ' CG1' ' CG2' ' A' ' 136' ' ' THR . 34.9 t -60.17 110.38 2.8 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.177 -0.465 . . . . 74.13 111.112 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.448 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.7 Cg_endo -78.42 142.54 18.75 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.615 2.21 . . . . 72.43 112.512 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -83.84 153.48 24.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 71.42 110.833 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.17 110.45 0.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.184 -0.462 . . . . 74.32 111.327 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.56 -18.98 43.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.495 . . . . 64.21 111.2 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.449 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 1.4 m-90 -135.01 172.92 12.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.067 0.461 . . . . 64.34 110.761 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.4 m -110.2 148.58 31.56 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.731 -0.668 . . . . 73.12 110.103 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.48 ' O ' ' CG ' ' A' ' 16' ' ' ARG . 58.2 t -56.32 -33.58 38.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.96 0.41 . . . . 74.45 110.211 179.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' SER . 3.9 mt-10 -69.92 -25.74 63.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.803 -0.635 . . . . 72.03 110.791 179.222 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -82.02 -54.9 4.93 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.337 -0.392 . . . . 72.13 111.273 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mt -50.0 -66.71 0.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.082 0.401 . . . . 73.44 112.082 -178.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.48 ' CG ' ' O ' ' A' ' 12' ' ' VAL . 1.8 ptm180 -61.59 -23.09 65.77 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 120.895 -0.322 . . . . 73.1 111.622 -178.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 0.5 OUTLIER -54.61 178.57 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.739 0.304 . . . . 70.41 110.847 179.773 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -110.27 11.39 23.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.326 -0.397 . . . . 73.44 111.434 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -103.47 -26.18 12.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.765 0.317 . . . . 73.43 111.12 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.449 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 8.5 tt -87.53 130.72 46.24 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.348 -0.387 . . . . 74.11 110.91 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -74.25 127.92 11.65 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.505 2.137 . . . . 54.14 112.369 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -25.06 66.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 75.04 111.193 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.8 mmtp -54.08 -39.19 66.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.852 0.358 . . . . 72.34 111.351 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.41 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 0.8 OUTLIER -70.05 -58.35 3.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.198 -0.456 . . . . 74.51 111.093 -179.896 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 17.9 mt -44.7 -32.62 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.864 -0.607 . . . . 64.13 111.577 -179.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 8.1 mt -75.11 -37.2 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.363 -0.381 . . . . 74.14 111.008 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 mttm -72.43 -23.88 61.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.016 -0.538 . . . . 73.43 111.258 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -73.73 -45.88 49.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.967 0.413 . . . . 73.14 110.917 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.6 mt -67.89 -24.96 65.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.862 -0.608 . . . . 74.42 110.998 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -80.46 -27.86 37.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.35 -0.386 . . . . 74.01 110.98 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.417 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 15.7 pt-20 -94.01 -41.63 9.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.298 -0.41 . . . . 63.1 111.034 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.448 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 21.2 m170 -98.51 16.54 21.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.285 -0.416 . . . . 65.12 111.035 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.26 154.37 23.98 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.81 -0.71 . . . . 75.2 112.525 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.1 p -88.6 148.26 24.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.66 0.267 . . . . 72.45 110.653 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -48.8 -57.12 6.87 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.784 0.325 . . . . 73.02 110.988 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.5 t -48.03 -51.15 25.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.195 -0.457 . . . . 71.53 110.724 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.498 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 17.1 t80 -55.12 -45.55 75.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.759 -0.655 . . . . 75.24 110.16 179.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.4 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 14.7 mt -63.47 -43.56 96.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.933 -0.576 . . . . 74.12 110.477 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -47.5 -34.26 7.29 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.13 -0.487 . . . . 71.11 110.575 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -50.55 -48.36 57.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.65 -0.704 . . . . 73.43 110.76 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -106.36 16.25 25.01 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.947 -0.57 . . . . 74.44 110.883 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.8 mttt 57.27 40.95 27.45 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.833 0.349 . . . . 75.15 110.952 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 51.0 mt -91.59 -25.38 19.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 62.14 111.597 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.4 ' N ' ' HB3' ' A' ' 38' ' ' LEU . 0.3 OUTLIER -69.79 158.34 35.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.017 0.437 . . . . 71.55 111.114 -179.761 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.19 -124.77 6.45 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.775 -0.648 . . . . 75.2 112.359 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -116.39 122.57 45.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.794 0.33 . . . . 71.2 110.88 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mp -46.13 -49.4 5.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.219 -0.446 . . . . 74.22 111.29 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.5 mttt -50.75 -39.56 52.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.98 -0.555 . . . . 71.45 110.846 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -85.68 -26.28 26.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.869 -0.605 . . . . 73.3 110.934 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 28.5 t -78.8 -25.85 13.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 75.12 111.284 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.56 -19.98 64.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.398 -0.364 . . . . 71.2 111.252 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.1 ptpt -95.06 -33.05 12.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.379 -0.373 . . . . 73.44 110.909 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.83 31.79 2.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 73.52 110.977 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -156.08 125.07 6.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 74.12 111.061 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -84.07 171.7 12.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 72.34 110.722 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.71 -58.08 9.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.917 0.389 . . . . 74.54 110.556 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.3 -25.71 67.3 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.036 -0.529 . . . . 44.43 110.537 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -46.83 84.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 70.12 110.515 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 21.9 mt -72.15 -31.18 65.74 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.657 -0.702 . . . . 73.12 111.228 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 15.2 t -79.75 -42.82 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.974 0.416 . . . . 63.41 110.907 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 92.2 m -59.33 -38.02 79.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.941 -0.572 . . . . 73.25 110.774 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -80.89 -21.81 40.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.314 -0.403 . . . . 74.12 111.108 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.407 ' CD1' ' O ' ' A' ' 63' ' ' TYR . 12.9 t80 -82.85 -22.87 33.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 73.41 110.986 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 31.8 m-20 -84.97 -53.62 5.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 51.23 111.583 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.498 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.2 p-80 -61.6 -30.3 70.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.134 -0.485 . . . . 75.23 111.364 -179.423 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.444 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.1 tt -50.21 -39.83 45.43 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.875 0.369 . . . . 74.21 111.101 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -78.8 -36.79 42.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.065 -0.516 . . . . 75.12 110.598 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.12 -38.16 81.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 73.23 110.843 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.8 p -92.73 -6.25 49.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.024 -0.535 . . . . 73.35 111.387 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt 51.55 36.53 17.28 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.768 0.318 . . . . 75.34 111.34 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 41.9 mtt-85 -93.48 44.18 1.13 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.34 -0.391 . . . . 73.21 111.026 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.427 ' CD2' HD23 ' A' ' 66' ' ' LEU . 85.3 m-85 -64.59 173.12 2.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.297 -0.41 . . . . 73.44 110.786 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -62.76 153.03 34.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.273 -0.422 . . . . 74.4 110.9 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -116.32 -111.59 2.71 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.735 -0.745 . . . . 62.11 112.501 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -170.2 102.19 0.28 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.867 0.365 . . . . 74.14 110.848 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -111.46 -33.63 6.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.126 -0.488 . . . . 72.5 110.915 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 71.0 p -132.97 140.33 47.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.232 -0.44 . . . . 74.44 110.945 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.4 ' CD1' ' N ' ' A' ' 79' ' ' SER . 2.6 pp -157.47 -44.38 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 73.52 111.212 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' SER . . . . . 0.4 ' N ' ' CD1' ' A' ' 78' ' ' ILE . 22.0 m -92.86 -33.1 14.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.069 -0.514 . . . . 73.12 110.893 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.0 tttp -92.16 152.22 20.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.452 . . . . 74.03 110.941 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.8 m -157.08 110.53 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 74.31 111.142 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -177.0 174.87 1.65 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 53.34 110.905 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 63.84 -79.96 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.195 -0.457 . . . . 75.52 111.004 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -90.51 121.54 32.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.152 -0.476 . . . . 73.24 110.912 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 19.6 t 64.05 133.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 75.11 111.097 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.1 tttp -97.65 25.58 5.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 73.33 111.125 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.9 m120 56.74 104.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.339 -0.391 . . . . 73.43 111.086 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 20.9 t 63.85 151.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 75.41 111.095 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 4.4 mmmt -86.46 -35.3 19.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 73.43 110.884 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.6 mp -147.85 126.59 12.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 72.51 110.903 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -176.88 169.5 2.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.468 . . . . 74.2 110.858 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -81.94 -179.37 7.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 75.44 110.882 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -101.14 120.1 39.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 61.22 110.89 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.94 87.24 40.79 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 51.31 110.886 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.97 168.05 22.96 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.531 2.154 . . . . 74.35 112.281 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? 60.72 104.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 73.22 110.862 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -109.43 -34.1 6.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 73.5 110.914 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.0 t 43.31 68.8 0.46 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.085 -0.507 . . . . 72.14 111.441 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 9.1 tmtt? -60.16 108.21 0.75 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.477 . . . . 74.34 110.863 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.73 -170.16 2.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 73.11 110.898 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -102.42 -31.56 10.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 63.51 110.883 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 60.47 168.95 0.09 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.244 -0.435 . . . . 75.5 110.911 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 37.4 p -111.44 -178.07 3.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 74.35 110.89 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.5 tt -129.95 117.53 20.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.453 . . . . 74.53 110.861 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -112.06 -34.79 5.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.15 -0.477 . . . . 75.42 110.896 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -96.84 110.77 23.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 74.12 110.889 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 154.7 99.35 0.17 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.65 -0.786 . . . . 70.41 112.476 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.515 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 32.3 Cg_exo -56.4 -46.03 33.23 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.443 2.095 . . . . 75.15 112.839 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . 0.515 ' CD ' ' N ' ' A' ' 108' ' ' PRO . 90.9 Cg_endo -82.11 171.23 12.94 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 123.049 2.499 . . . . 73.12 112.263 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.47 ' CG ' ' CD1' ' A' ' 196' ' ' TRP . 8.4 mmtt -110.41 27.36 9.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 71.51 111.043 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -132.62 151.16 52.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.904 0.383 . . . . 71.32 111.022 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 63.8 m -130.94 103.64 6.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.034 -0.53 . . . . 73.32 111.099 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -101.73 142.31 33.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.331 -0.395 . . . . 74.13 110.978 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.5 m -140.78 118.0 11.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.477 . . . . 70.44 110.76 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 39.7 t -57.65 154.75 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 75.22 111.336 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 4.1 mp -132.8 -46.59 0.87 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.977 -0.556 . . . . 73.0 110.571 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.7 tttm -130.42 108.23 9.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.006 -0.543 . . . . 74.55 110.707 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 20.0 pttt -61.2 131.54 50.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 70.11 110.913 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -100.12 -106.06 2.76 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.713 -0.756 . . . . 74.41 112.345 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.44 -40.21 11.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.916 0.389 . . . . 75.43 110.733 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.9 mtmt 66.75 32.56 6.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.969 -0.56 . . . . 70.12 110.686 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 63.3 m -148.61 -45.14 0.15 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.06 -0.518 . . . . 74.25 110.947 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -91.24 122.24 33.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 54.51 111.0 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -129.07 147.55 65.33 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 75.11 110.88 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.96 127.4 24.76 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.592 2.195 . . . . 61.42 112.472 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.2 140.66 32.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.182 -0.463 . . . . 75.55 110.777 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -51.88 113.71 1.08 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.242 -0.436 . . . . 74.44 111.172 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.89 -15.14 55.75 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.729 -0.748 . . . . 75.23 112.741 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -88.1 140.95 28.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.826 0.346 . . . . 74.31 111.028 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.438 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 7.6 p -70.91 163.29 3.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.08 -0.509 . . . . 74.31 110.974 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.632 ' O ' ' HA ' ' A' ' 163' ' ' SER . 14.0 m -155.21 146.76 13.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 74.2 111.176 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.469 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.64 118.0 23.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.711 0.291 . . . . 65.12 110.751 179.705 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 28.1 p -149.04 166.59 28.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.035 0.445 . . . . 74.41 111.207 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.455 ' HB3' ' CD1' ' A' ' 149' ' ' ILE . 93.3 m95 -101.8 160.16 14.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.766 -0.652 . . . . 73.15 110.261 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.449 ' CE2' ' ND2' ' A' ' 148' ' ' ASN . 53.1 p90 -163.28 139.48 6.99 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.129 0.49 . . . . 75.21 112.1 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.411 ' CG2' ' CG1' ' A' ' 5' ' ' VAL . 6.9 m -131.22 116.04 17.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.575 -0.739 . . . . 74.42 110.108 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.54 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.65 144.61 17.34 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.661 -0.78 . . . . 55.35 113.443 -179.26 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.75 136.32 16.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.808 0.337 . . . . 74.43 110.411 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 31.3 mt -67.81 -178.34 0.94 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 73.01 110.979 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -56.59 -42.1 78.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 75.15 110.89 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.43 -2.48 35.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.976 -0.557 . . . . 74.13 111.504 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 88.57 25.78 29.38 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.664 -0.779 . . . . 50.52 112.672 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 31.0 m -90.61 116.37 28.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.8 0.333 . . . . 72.44 110.816 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 24.1 t -63.61 130.24 28.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 74.45 111.064 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.427 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 55.1 p90 -114.68 -31.06 6.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 74.24 111.106 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . 0.417 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 2.7 m-20 -168.1 117.5 0.77 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.385 -0.371 . . . . 71.41 111.072 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 15.0 t -142.87 129.52 20.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 75.01 110.94 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . 0.449 ' ND2' ' CE2' ' A' ' 135' ' ' TYR . 35.8 p-10 -92.54 50.08 1.56 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.262 -0.426 . . . . 65.43 110.373 179.544 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.455 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 19.2 mm -126.95 106.67 15.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.126 -0.488 . . . . 74.3 110.893 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -102.75 -77.31 0.56 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.444 . . . . 62.43 110.975 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 61.8 p -146.53 166.06 27.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 71.33 110.919 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 11.1 m -86.24 159.46 19.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 71.24 110.874 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -66.84 -30.39 70.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 52.32 111.153 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.76 -31.3 69.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 75.43 110.959 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -85.72 -34.38 21.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 75.31 110.907 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -177.3 152.35 0.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 75.43 110.911 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 25.2 mmtt -85.08 76.07 10.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.227 -0.442 . . . . 75.34 110.871 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -154.53 48.35 0.59 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 60.14 110.785 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.2 120.78 4.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 55.05 111.032 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -137.13 133.76 18.61 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 65.02 110.897 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . 0.428 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 34.5 Cg_exo -56.95 155.94 25.97 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.37 2.047 . . . . 63.25 112.204 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 2.6 tt -77.96 119.67 21.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.452 . . . . 75.54 110.382 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.632 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -97.69 121.84 40.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.395 . . . . 75.14 111.384 -179.721 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 10.8 p90 -150.36 142.67 24.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.995 -0.548 . . . . 73.43 110.597 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 7.2 mtpt -81.26 141.03 34.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.981 0.42 . . . . 65.04 111.028 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.0 m -87.44 149.18 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.837 -0.62 . . . . 72.04 111.138 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 66.91 26.28 73.2 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.792 -0.718 . . . . 71.3 112.269 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 2.0 t -131.18 41.19 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.831 0.348 . . . . 75.43 110.984 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.02 34.84 3.23 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 121.105 -0.569 . . . . 73.3 112.966 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.62 -45.8 13.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.885 0.374 . . . . 73.04 111.016 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.1 m -118.41 179.55 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.042 -0.526 . . . . 73.24 111.066 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.504 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -61.82 159.07 2.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.262 -0.426 . . . . 74.43 111.246 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -65.08 -30.16 71.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.158 -0.474 . . . . 73.23 111.292 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.8 -36.21 43.04 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.529 -0.843 . . . . 53.43 112.197 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.504 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.5 t90 -80.22 -36.06 35.3 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.914 0.388 . . . . 72.03 110.91 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -60.89 -36.4 79.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.993 -0.549 . . . . 75.4 110.37 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -78.04 -29.04 49.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.957 -0.565 . . . . 71.02 110.627 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -77.71 -60.44 2.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.202 -0.453 . . . . 75.04 111.144 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.49 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 7.1 mt -55.54 -35.98 66.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.984 -0.553 . . . . 74.02 110.897 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.7 tp -62.11 -28.77 69.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.224 -0.444 . . . . 70.12 110.835 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 37.0 p -89.32 -8.54 53.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 75.14 111.369 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 9.4 mmm -75.47 159.4 31.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.762 0.315 . . . . 75.24 110.829 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.91 166.78 10.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 73.23 111.079 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 5.5 tttm -65.56 123.35 19.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 73.44 111.095 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 70.24 39.27 71.79 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.737 -0.744 . . . . 55.25 112.702 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -121.16 149.78 42.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.834 0.35 . . . . 75.02 110.999 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -116.53 139.29 50.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 75.03 110.226 179.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -147.79 175.84 10.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.058 0.456 . . . . 73.31 111.642 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.7 124.49 21.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.722 -0.672 . . . . 73.31 109.838 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -135.91 142.14 44.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.187 0.518 . . . . 74.41 112.152 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -117.35 113.42 22.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.416 -0.811 . . . . 74.24 110.15 179.302 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.481 ' CD1' ' CZ ' ' A' ' 216' ' ' PHE . 4.6 mp -96.57 142.77 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.975 0.417 . . . . 73.43 111.458 -179.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -78.77 164.43 55.51 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 115.88 -0.6 . . . . 74.21 110.834 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.83 -41.43 75.53 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.661 2.241 . . . . 62.34 112.409 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -63.28 -39.0 93.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 71.03 111.162 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . 0.47 ' CD1' ' CG ' ' A' ' 110' ' ' LYS . 9.0 m0 -96.3 27.1 3.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.359 -0.382 . . . . 74.33 111.103 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -150.04 -81.84 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 73.22 110.792 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -104.25 -71.27 0.74 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.039 0.447 . . . . 74.23 110.444 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 145.83 -174.36 25.82 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.823 -0.703 . . . . 72.02 112.808 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -56.9 -40.96 77.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.826 0.346 . . . . 73.55 110.895 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.46 -52.01 65.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.126 -0.488 . . . . 74.54 110.592 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.1 -139.46 14.56 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.84 -0.695 . . . . 63.13 112.519 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -150.89 90.35 4.19 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 120.656 0.265 . . . . 72.22 110.621 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -61.86 -22.57 74.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.523 2.149 . . . . 73.32 112.668 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.65 -42.18 64.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.86 0.362 . . . . 72.14 110.889 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -97.59 25.76 5.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.064 -0.516 . . . . 74.22 111.358 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 54.71 32.45 17.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.344 -0.389 . . . . 73.53 111.16 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . . . . . . . . . 20.2 mm -95.72 111.79 56.96 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 73.44 111.118 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.23 171.46 11.48 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.34 2.027 . . . . 75.1 112.171 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -68.72 122.17 9.1 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.535 2.157 . . . . 61.41 112.314 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 71.42 34.47 1.7 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.214 -0.448 . . . . 75.04 110.988 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -83.86 147.38 27.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.046 0.45 . . . . 74.44 111.768 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.62 148.05 24.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.776 -0.647 . . . . 61.01 110.367 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 5.5 mt -130.03 109.11 10.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.883 0.373 . . . . 71.22 111.767 -179.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 50.3 m -111.3 141.45 44.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.109 -0.496 . . . . 75.34 110.612 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.54 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 11.6 p90 -153.96 178.17 10.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.107 0.48 . . . . 70.23 111.717 -179.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -127.9 132.13 49.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.604 -0.725 . . . . 70.41 110.123 179.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 2.4 t -120.8 149.04 23.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.121 0.486 . . . . 72.43 112.034 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -136.73 109.85 7.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.584 -0.734 . . . . 75.14 110.253 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 3.2 tt -69.92 134.33 48.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.342 -0.39 . . . . 74.41 110.89 -179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 40.4 t -112.08 -29.96 2.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.252 -0.431 . . . . 73.05 111.392 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -168.82 158.71 9.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.821 0.343 . . . . 62.31 111.176 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 35.1 mt -141.62 111.53 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 75.11 111.168 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 75.31 110.841 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.823 0.344 . . . . 75.42 111.157 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -175.23 124.53 0.24 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.179 -0.464 . . . . 71.35 111.06 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.36 30.4 2.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.476 . . . . 75.01 111.155 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.75 154.65 41.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 63.54 111.078 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.5 t -60.05 110.5 2.88 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.183 -0.462 . . . . 71.21 111.086 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.415 ' HD2' ' CE1' ' A' ' 72' ' ' PHE . 90.2 Cg_endo -80.7 146.15 16.59 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.813 2.342 . . . . 75.15 112.469 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -84.34 152.21 24.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 75.22 110.743 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 mpp_? -52.4 121.31 6.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 74.1 111.116 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -93.78 -13.05 27.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 72.22 111.376 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.469 ' CD1' ' CD1' ' A' ' 20' ' ' LEU . 1.2 m-90 -137.12 173.73 11.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.877 0.37 . . . . 74.24 110.681 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 m -117.11 151.36 36.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.06 -0.518 . . . . 70.33 110.58 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.4 t -57.18 -33.17 42.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.065 0.46 . . . . 75.13 110.364 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.53 -28.25 61.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.696 -0.684 . . . . 74.44 111.058 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -82.06 -57.75 3.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.323 -0.399 . . . . 74.41 110.994 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.5 mt -50.32 -62.24 1.7 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.198 -0.456 . . . . 74.31 111.092 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.0 mtt180 -54.37 -24.35 19.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 74.11 111.268 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.98 173.69 0.31 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.334 -0.394 . . . . 65.44 111.082 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.32 16.35 21.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 72.44 111.237 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -107.73 -25.32 11.33 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.547 -0.297 . . . . 74.42 111.011 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.469 ' CD1' ' CD1' ' A' ' 10' ' ' TRP . 10.3 tt -86.13 129.48 53.69 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.293 -0.412 . . . . 73.21 110.874 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.29 123.14 9.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.332 2.021 . . . . 64.12 112.32 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -24.06 66.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.22 111.211 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.9 mmtp -53.38 -39.31 64.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.396 -0.365 . . . . 74.31 111.396 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -79.02 -29.04 43.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.324 -0.398 . . . . 73.4 111.209 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.42 HD12 HG21 ' A' ' 25' ' ' ILE . 49.0 mt -66.18 -37.12 79.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.32 -0.4 . . . . 65.34 111.096 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 10.3 mt -72.53 -44.47 61.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 73.11 110.938 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -59.53 -24.17 63.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.847 -0.615 . . . . 73.12 111.026 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -74.87 -50.08 18.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 73.21 110.894 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.1 mt -65.13 -40.69 94.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.963 -0.562 . . . . 74.44 110.919 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -67.89 -23.73 65.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.219 -0.446 . . . . 74.31 110.492 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -88.03 -48.21 7.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.086 -0.506 . . . . 75.55 110.885 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -97.23 16.44 19.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 74.34 111.307 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -131.34 151.93 19.86 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.661 -0.781 . . . . 73.22 112.408 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.83 154.05 19.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.685 0.279 . . . . 73.04 110.618 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -46.98 -52.67 14.14 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.527 -0.306 . . . . 74.43 111.337 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 57.8 m -53.01 -46.54 68.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.012 0.434 . . . . 63.11 110.68 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.444 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 11.2 t80 -56.6 -48.25 77.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.785 -0.643 . . . . 75.31 110.726 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.439 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 13.4 mt -63.46 -45.2 91.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 74.3 110.889 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.07 -34.01 8.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 71.2 111.155 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -59.22 -55.39 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.996 -0.547 . . . . 71.13 111.025 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 -95.59 15.29 20.25 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.175 -0.466 . . . . 75.11 111.411 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 mttp 60.08 38.24 20.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.736 0.303 . . . . 72.53 111.182 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.419 ' HB2' ' HB3' ' A' ' 38' ' ' LEU . 14.3 mt -85.12 -21.76 29.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.373 -0.376 . . . . 63.24 110.796 179.637 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.439 ' N ' ' HB3' ' A' ' 38' ' ' LEU . 81.2 mt -47.08 170.82 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.175 -0.466 . . . . 75.33 111.344 179.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.71 -148.95 20.2 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.913 -0.661 . . . . 62.24 112.869 179.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -114.85 149.16 37.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.005 0.431 . . . . 74.32 111.16 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mp -45.62 -42.03 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.847 -0.615 . . . . 60.31 111.599 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.21 -43.45 82.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.961 -0.563 . . . . 75.13 111.198 -179.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -85.71 -27.1 25.51 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.076 -0.511 . . . . 74.45 111.292 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.3 t -76.74 -26.2 16.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.386 -0.37 . . . . 73.13 111.441 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.78 -25.39 65.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.442 -0.344 . . . . 50.12 111.366 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.29 -30.54 13.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 74.42 111.103 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -84.05 -19.76 33.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.264 -0.426 . . . . 72.03 111.471 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -117.74 130.13 56.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.865 0.364 . . . . 74.51 111.32 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -78.65 -179.09 6.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 73.01 110.48 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.5 tpmp? -61.4 -58.45 8.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.796 0.332 . . . . 74.3 110.524 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -25.51 67.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.196 -0.456 . . . . 75.44 110.646 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.04 -40.06 94.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.11 0.481 . . . . 74.43 110.214 179.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 15.3 mt -77.07 -30.14 55.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.619 -0.719 . . . . 73.22 111.013 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 17.3 t -79.66 -43.48 23.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.991 0.424 . . . . 75.32 110.737 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 63.7 m -59.32 -34.8 72.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.945 -0.571 . . . . 61.5 110.448 179.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.408 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -82.64 -21.19 35.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.544 . . . . 72.53 110.997 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.4 ' O ' ' CD1' ' A' ' 63' ' ' TYR . 14.2 t80 -83.63 -22.64 32.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.094 -0.503 . . . . 74.43 110.918 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 30.2 m-20 -85.06 -53.88 4.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 74.1 111.401 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.428 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.8 p-80 -62.33 -27.27 68.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.097 -0.501 . . . . 73.44 111.323 -179.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.444 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 3.8 tt -50.82 -40.79 56.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.899 0.38 . . . . 71.45 111.065 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.405 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.6 m-85 -79.05 -40.06 32.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.035 -0.53 . . . . 74.02 110.679 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -64.88 -39.75 94.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.961 -0.563 . . . . 74.32 110.972 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.2 p -88.98 -10.38 47.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.001 -0.545 . . . . 72.5 111.399 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt 53.55 33.21 15.77 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.683 0.277 . . . . 75.04 111.21 179.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -92.42 45.84 1.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 75.32 111.026 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.432 ' CD1' HD21 ' A' ' 66' ' ' LEU . 94.5 m-85 -64.86 171.87 3.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 62.4 110.801 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 33.9 tttt -62.87 150.91 40.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.325 -0.398 . . . . 73.31 110.914 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -91.09 -137.28 7.21 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.696 -0.764 . . . . 43.22 112.455 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -115.04 -38.47 3.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.906 0.384 . . . . 74.35 110.93 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 58.57 75.46 0.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.102 -0.499 . . . . 74.34 110.916 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.4 t 60.42 158.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 64.11 110.926 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 4.1 pt -158.73 145.15 7.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 75.01 111.11 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 34.3 p -67.01 135.62 54.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 64.41 110.896 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.15 30.96 3.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 74.13 110.91 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.4 t 62.1 116.58 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 74.45 111.149 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -129.97 149.35 51.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 71.42 110.875 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -128.79 -49.71 1.24 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 72.42 110.89 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -141.76 125.65 17.12 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.923 -0.58 . . . . 74.41 110.892 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -110.13 -32.35 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.443 . . . . 73.5 111.123 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.41 179.43 4.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 72.41 110.91 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -135.44 169.15 17.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 72.01 110.857 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 12.7 p 43.82 35.26 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-N 116.073 -0.512 . . . . 71.12 111.595 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -132.63 -45.49 0.89 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.126 -0.488 . . . . 75.44 110.969 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -129.76 134.66 47.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.089 -0.505 . . . . 73.01 110.894 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -107.47 -33.12 7.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.255 -0.43 . . . . 65.0 110.947 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 60.64 157.71 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.187 -0.46 . . . . 74.34 110.911 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -110.9 -33.57 6.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.223 -0.444 . . . . 74.23 110.919 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -173.84 86.97 0.36 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 73.02 110.892 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.95 139.06 38.66 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.616 2.21 . . . . 72.54 112.306 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -142.85 123.64 14.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.262 -0.426 . . . . 73.45 110.894 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -143.49 142.87 31.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 74.1 110.875 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 20.7 p -138.04 130.31 29.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 74.43 110.969 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.99 139.93 36.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 72.0 110.892 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.3 m -126.84 159.4 34.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 73.04 110.9 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -104.62 -32.97 8.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 75.12 110.899 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -95.23 152.51 18.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.187 -0.461 . . . . 42.22 110.941 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 58.5 p -94.16 -33.56 13.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 74.41 110.922 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 59.89 96.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 73.11 110.916 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -107.57 -36.81 6.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 73.44 110.907 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -165.12 -43.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.094 -0.503 . . . . 73.24 111.02 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 133.58 69.49 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.792 -0.718 . . . . 60.44 112.512 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.82 176.47 6.77 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.584 2.19 . . . . 74.05 112.313 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -57.41 -159.49 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.671 2.247 . . . . 75.24 112.289 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.43 ' CB ' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -97.24 28.03 3.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 73.41 111.048 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.422 ' CE1' ' HB1' ' A' ' 178' ' ' ALA . 29.5 p90 -152.64 151.61 30.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.295 -0.412 . . . . 73.53 110.848 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 74.1 m -122.14 103.54 8.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 74.45 110.857 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.9 ttpt -95.92 145.52 25.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.328 -0.397 . . . . 73.1 111.11 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.7 m -138.35 117.78 12.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 72.33 110.727 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 22.8 t -81.07 106.36 12.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.294 -0.412 . . . . 64.45 111.267 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.23 -42.0 19.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 74.32 110.67 179.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -125.05 107.72 11.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 65.31 110.927 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.1 mtmp? -63.64 139.29 58.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 73.22 110.953 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -112.67 -155.02 12.09 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.779 -0.724 . . . . 65.01 112.279 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -33.59 -50.46 0.34 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.917 0.389 . . . . 63.24 111.705 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.1 tttt 71.65 35.64 1.39 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.028 -0.533 . . . . 74.4 110.177 -179.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 75.0 m -163.62 -43.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.664 -0.698 . . . . 73.12 110.525 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -85.3 88.63 7.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.048 -0.524 . . . . 74.45 110.713 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -104.6 155.14 37.85 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 72.41 110.763 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -69.49 125.55 12.41 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.433 2.089 . . . . 62.32 112.436 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -95.46 152.29 18.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.007 -0.542 . . . . 74.43 110.9 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.99 116.95 3.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.278 -0.419 . . . . 73.45 110.981 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 100.59 -26.99 22.52 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.73 -0.748 . . . . 75.33 112.519 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -73.13 137.62 45.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.835 0.35 . . . . 71.05 110.905 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.416 HG12 ' N ' ' A' ' 131' ' ' VAL . 1.2 t -71.16 163.65 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 74.14 110.944 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.55 ' O ' ' HA ' ' A' ' 163' ' ' SER . 2.8 m -153.77 145.27 14.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.038 -0.528 . . . . 74.43 110.884 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.449 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.3 OUTLIER -127.18 117.72 22.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.708 0.289 . . . . 75.13 110.658 179.591 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.415 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 28.4 p -153.23 167.64 28.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.965 0.412 . . . . 73.25 111.15 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.42 ' CE2' ' HG3' ' A' ' 161' ' ' PRO . 8.4 m95 -102.64 162.98 12.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.928 -0.578 . . . . 73.22 110.067 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.46 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 46.3 p90 -162.3 138.4 7.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.078 0.466 . . . . 74.34 111.667 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.49 112.64 15.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.674 -0.694 . . . . 73.04 110.477 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.572 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.5 143.7 16.87 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.619 -0.801 . . . . 60.02 113.001 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -151.47 139.01 19.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.758 0.313 . . . . 73.54 110.539 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 70.8 mt -72.0 -178.58 2.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.288 -0.415 . . . . 70.13 111.031 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -58.3 -42.32 86.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 73.11 110.752 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.87 -4.41 40.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.927 -0.579 . . . . 73.45 111.418 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 90.68 21.73 36.04 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.674 -0.774 . . . . 72.14 112.726 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -90.66 109.12 20.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.8 0.333 . . . . 61.22 110.686 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.1 m -63.58 139.93 20.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 73.35 111.165 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 33.7 p90 -118.85 -40.53 2.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.055 -0.52 . . . . 64.04 111.071 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -155.17 119.98 4.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.074 -0.512 . . . . 71.41 110.727 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 3.5 t -142.82 129.39 20.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.279 -0.419 . . . . 73.44 111.327 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . 0.46 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 26.3 t30 -93.62 46.65 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 72.41 110.435 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.409 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 17.6 mm -113.29 89.36 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.923 -0.581 . . . . 72.03 110.905 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -81.4 -173.49 4.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 62.32 110.877 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 41.8 p -64.82 165.95 9.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.126 -0.488 . . . . 74.0 110.927 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 11.3 p -69.73 158.04 36.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 63.42 110.943 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -78.54 -28.37 46.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 73.34 111.165 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.1 tptm -57.62 -28.94 64.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.212 -0.449 . . . . 75.42 111.032 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 9.7 mmtm -58.86 -63.14 1.4 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.955 0.407 . . . . 75.24 110.918 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -166.92 32.03 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.912 -0.585 . . . . 74.23 110.935 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 22.6 mttt 56.22 75.62 0.33 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 73.32 110.981 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -140.64 50.4 1.67 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 73.32 110.89 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -149.08 125.19 10.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 61.2 111.129 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 5.7 tttm -138.69 120.36 10.26 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 75.34 110.863 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . 0.42 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 43.7 Cg_exo -56.33 150.96 47.11 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.378 2.052 . . . . 64.22 112.28 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 5.5 tt -74.17 121.73 21.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 74.54 110.563 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.55 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.1 OUTLIER -99.29 120.36 39.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.94 0.4 . . . . 72.23 111.11 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -148.47 140.66 24.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.045 -0.525 . . . . 75.51 110.455 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -80.19 139.1 36.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.066 0.46 . . . . 74.22 111.192 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.8 m -87.77 149.17 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.738 -0.664 . . . . 73.13 111.16 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.53 21.92 78.68 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.831 -0.7 . . . . 71.31 112.822 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 16.0 m -128.0 41.68 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.881 0.372 . . . . 74.21 111.18 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 41.21 38.19 1.8 Allowed Glycine 0 C--N 1.332 0.356 0 CA-C-N 115.975 -0.557 . . . . 71.15 113.403 179.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 6.8 mtpp -87.38 -39.95 14.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.807 0.337 . . . . 74.32 111.077 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . 0.409 HG13 ' CE3' ' A' ' 175' ' ' TRP . 1.5 m -119.03 177.13 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.205 -0.452 . . . . 75.44 110.925 179.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.5 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.42 158.6 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.339 -0.391 . . . . 75.24 111.331 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -67.34 -26.75 66.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.096 -0.502 . . . . 72.55 111.072 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.46 -37.07 36.77 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.615 -0.802 . . . . 74.33 112.087 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.5 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.5 t90 -78.2 -33.72 49.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.965 0.412 . . . . 75.32 111.044 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -64.65 -36.56 84.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.99 -0.55 . . . . 74.11 110.525 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -75.5 -29.58 59.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.025 -0.534 . . . . 73.4 110.648 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . 0.422 ' HB1' ' CE1' ' A' ' 111' ' ' TYR . . . -81.46 -46.5 14.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 64.44 111.125 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.463 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 10.6 mt -70.67 -18.97 62.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.977 -0.556 . . . . 73.24 111.117 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 2.2 tp -55.31 -23.06 21.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.453 -0.34 . . . . 74.11 111.453 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 27.0 p -115.95 19.92 14.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.588 -0.278 . . . . 74.23 111.565 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 2.2 mmt -66.17 108.15 2.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.843 0.354 . . . . 71.43 110.89 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.78 145.23 43.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 73.53 110.853 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.67 115.53 2.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 73.3 111.191 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 76.61 21.88 73.8 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.967 -0.635 . . . . 73.33 113.002 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -98.38 144.56 27.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.875 0.369 . . . . 72.52 111.201 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 10.6 ttpt -117.1 139.09 51.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.04 -0.527 . . . . 73.22 110.077 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.64 174.34 11.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.177 0.513 . . . . 62.11 112.0 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.54 107.35 6.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.478 -0.783 . . . . 74.31 109.701 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.425 ' HG ' ' CE1' ' A' ' 216' ' ' PHE . 1.0 OUTLIER -120.16 142.06 49.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.184 0.516 . . . . 73.35 112.105 -178.855 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.32 119.72 37.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.54 -0.755 . . . . 73.11 110.112 179.272 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -98.26 151.29 4.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.911 0.386 . . . . 74.31 111.173 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -86.76 165.14 34.0 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.518 . . . . 65.33 110.715 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -62.12 -42.19 31.0 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.492 2.128 . . . . 73.12 112.246 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -59.0 -39.0 80.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.265 -0.425 . . . . 74.13 111.066 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . 0.43 ' CD2' ' CB ' ' A' ' 110' ' ' LYS . 8.9 m0 -97.6 36.94 1.43 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.324 -0.398 . . . . 75.34 110.985 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -162.75 -77.55 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.444 . . . . 74.44 110.749 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.455 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 23.0 m-85 -105.12 -71.22 0.75 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 72.0 110.516 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.21 175.46 14.1 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.873 -0.68 . . . . 74.53 112.845 179.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -26.38 63.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.782 0.325 . . . . 74.44 110.983 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -67.43 -52.61 37.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.976 0.417 . . . . 74.33 110.776 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 102.33 168.33 26.79 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.87 -0.681 . . . . 73.51 112.515 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . 0.419 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.5 OUTLIER -107.43 91.63 7.26 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.657 0.265 . . . . 74.4 110.791 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -66.95 -21.03 50.51 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.462 2.108 . . . . 75.52 112.477 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.05 -42.05 98.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.873 0.368 . . . . 72.21 110.949 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -105.92 31.18 5.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.102 -0.499 . . . . 72.32 111.15 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 30.9 mttt 54.33 28.28 9.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 74.02 111.039 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . 0.434 HD12 ' CE2' ' A' ' 198' ' ' TYR . 60.1 mt -89.07 113.55 56.64 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 73.41 110.966 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.26 171.5 11.45 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.447 2.098 . . . . 62.11 112.458 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.44 152.62 70.99 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.606 2.204 . . . . 74.51 112.378 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 46.4 32.14 1.48 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.19 -0.459 . . . . 74.41 111.228 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -79.9 144.29 33.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 75.13 111.483 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 18.5 tttt -89.55 144.72 25.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.938 -0.574 . . . . 74.31 110.258 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.455 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 8.0 mt -127.0 108.88 11.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.876 0.369 . . . . 75.52 111.7 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 56.2 m -109.67 143.18 39.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 71.11 110.501 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.572 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 15.0 p90 -156.05 178.38 10.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.108 0.48 . . . . 65.22 111.336 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -134.3 137.71 44.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.667 -0.697 . . . . 71.32 110.314 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 2.1 t -123.71 151.95 28.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.018 0.437 . . . . 74.14 111.876 -178.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -136.74 110.42 8.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.793 -0.639 . . . . 74.45 110.27 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . 0.415 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.47 132.81 46.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.426 -0.352 . . . . 74.44 110.758 -179.584 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 20.6 t -111.11 -31.45 2.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.279 -0.419 . . . . 64.42 111.469 -179.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -170.66 161.97 7.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.904 0.383 . . . . 71.4 110.983 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 4.2 mp -139.48 109.61 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 72.55 111.058 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 75.0 110.906 179.977 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 ttt . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.816 0.341 . . . . 72.24 111.195 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -140.29 82.1 1.84 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 72.3 111.098 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -161.31 78.54 0.57 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.467 . . . . 70.12 111.092 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.31 152.38 43.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 75.22 111.086 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 57.3 t -60.02 109.83 2.32 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.487 . . . . 73.33 111.062 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.425 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 98.3 Cg_endo -85.92 149.78 9.65 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 123.007 2.471 . . . . 73.34 112.552 -179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -84.43 147.2 27.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 43.21 110.972 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.28 99.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 74.13 111.234 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.42 -18.35 61.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 74.32 111.268 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.418 ' CH2' ' HB3' ' A' ' 24' ' ' ASP . 2.2 m-90 -131.81 173.35 11.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.865 0.364 . . . . 71.52 110.737 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.74 153.64 27.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.108 -0.496 . . . . 74.44 110.452 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 33.6 t -54.75 -35.01 31.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.983 0.42 . . . . 75.45 110.817 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.44 -34.32 78.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.985 -0.552 . . . . 71.43 111.069 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.5 -55.43 5.22 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.798 0.332 . . . . 75.22 111.044 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.2 mt -50.7 -30.76 14.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.993 0.425 . . . . 74.04 110.855 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 47.7 mtt180 -90.95 -28.77 17.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.829 -0.623 . . . . 75.31 110.397 179.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 31.0 t -49.37 176.0 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.901 -0.591 . . . . 74.24 111.484 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -110.37 17.41 20.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.746 -0.661 . . . . 74.41 111.234 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -117.67 -16.45 10.06 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.63 -0.259 . . . . 75.51 111.495 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 tt -87.72 112.49 49.07 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-O 120.55 0.214 . . . . 74.43 111.028 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.09 125.35 17.87 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.478 2.119 . . . . 64.22 112.182 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -24.23 62.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.444 . . . . 64.43 111.161 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -55.07 -43.64 74.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.366 -0.379 . . . . 73.53 111.474 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.418 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 1.5 m-20 -69.32 -54.8 12.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.27 -0.423 . . . . 74.51 111.202 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 41.1 mt -46.36 -33.25 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.929 -0.578 . . . . 72.23 111.422 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 8.2 mt -77.78 -38.03 24.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.315 -0.402 . . . . 73.41 111.033 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -67.11 -23.15 65.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.11 -0.495 . . . . 75.35 111.102 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -77.37 -49.8 14.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.036 0.446 . . . . 74.45 110.92 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.5 mt -61.77 -21.42 64.54 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.747 -0.661 . . . . 73.41 111.185 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -81.5 -58.72 2.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.99 0.424 . . . . 75.24 110.945 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -63.72 -37.45 87.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.844 -0.616 . . . . 75.34 111.746 -179.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.425 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 14.4 m170 -94.57 -7.9 39.75 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.764 0.283 . . . . 73.1 111.764 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.46 162.28 12.97 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.581 -0.819 . . . . 53.31 112.419 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.6 p -91.79 148.46 22.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.532 0.206 . . . . 53.3 110.524 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -48.98 -57.08 7.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.803 0.335 . . . . 74.05 111.136 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.8 t -48.1 -50.33 28.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.018 0.437 . . . . 72.22 110.772 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.513 ' CD1' ' HB2' ' A' ' 71' ' ' ARG . 15.9 t80 -54.09 -47.66 71.51 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.804 -0.635 . . . . 73.41 110.468 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 13.5 mt -64.88 -41.7 95.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.944 -0.571 . . . . 71.43 110.754 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.45 ' CB ' HD23 ' A' ' 44' ' ' LEU . . . -47.85 -42.18 25.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.09 0.471 . . . . 73.05 110.889 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -60.53 -28.09 68.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.686 -0.688 . . . . 74.14 110.883 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 -112.56 10.02 19.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.221 -0.445 . . . . 73.13 111.131 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.91 36.2 17.72 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.801 0.334 . . . . 73.11 110.987 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.6 mt -95.86 -19.79 19.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 74.44 111.756 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.45 HD23 ' CB ' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -77.13 159.66 29.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.077 0.465 . . . . 74.4 111.071 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.05 -122.22 5.56 Favored Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 115.706 -0.679 . . . . 74.0 112.367 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -116.39 119.19 34.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.784 0.326 . . . . 73.43 110.925 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mp -46.07 -52.84 2.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.205 -0.452 . . . . 64.13 111.33 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -48.06 -36.96 13.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.914 -0.585 . . . . 74.53 110.742 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -85.61 -26.1 26.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.874 -0.603 . . . . 74.21 110.884 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.6 t -79.99 -25.97 11.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.289 -0.414 . . . . 72.41 111.331 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.33 -23.75 67.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.386 -0.37 . . . . 73.34 111.102 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -95.28 -28.62 14.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.246 -0.434 . . . . 72.23 110.883 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.5 m -101.99 33.7 2.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 73.25 110.92 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -162.45 126.45 3.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 64.24 110.944 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.72 168.12 14.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.474 . . . . 72.02 110.704 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -58.11 7.93 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.896 0.379 . . . . 75.21 110.505 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.66 -28.56 65.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.144 -0.48 . . . . 74.15 110.187 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.48 96.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.897 -0.592 . . . . 73.3 110.264 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.6 mt -73.41 -32.0 64.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.564 -0.744 . . . . 74.45 110.977 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 33.9 t -78.4 -42.86 26.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.323 -0.399 . . . . 73.15 111.022 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.7 m -60.56 -33.99 73.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.023 -0.535 . . . . 71.24 110.521 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.448 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -82.04 -22.7 36.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.046 -0.524 . . . . 74.23 110.954 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -83.83 -22.81 31.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.142 -0.481 . . . . 74.54 110.989 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -84.15 -54.28 4.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 75.51 111.219 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.457 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.0 p-80 -62.94 -26.22 68.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.987 -0.551 . . . . 74.11 111.18 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.47 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 3.0 tt -48.94 -42.83 38.65 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.951 0.405 . . . . 74.24 110.91 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -79.02 -39.03 35.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.859 -0.609 . . . . 75.4 110.499 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.02 -45.13 96.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.951 -0.568 . . . . 75.51 110.685 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.5 p -89.89 -4.58 57.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.903 -0.589 . . . . 74.42 111.373 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.47 36.46 16.85 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.797 0.332 . . . . 72.24 111.24 179.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.513 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 7.3 mmt180 -88.58 46.05 1.35 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.246 -0.434 . . . . 72.22 111.517 -179.495 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.418 ' CD1' HD23 ' A' ' 66' ' ' LEU . 93.3 m-85 -68.17 173.22 4.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.8 0.333 . . . . 75.43 110.791 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -71.67 142.55 49.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.28 -0.418 . . . . 73.52 110.899 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 174.02 38.7 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.693 -0.765 . . . . 71.04 112.57 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.3 m -132.26 -45.24 0.92 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.883 0.373 . . . . 73.15 111.027 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -64.15 -33.21 75.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.987 -0.551 . . . . 73.31 110.957 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.26 120.77 42.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 55.05 110.966 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 28.2 pt -157.25 160.2 2.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 63.15 111.125 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 9.1 m -132.09 155.55 47.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 75.12 110.886 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -70.05 111.9 6.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.873 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -151.03 136.53 11.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 73.11 111.129 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.83 127.25 43.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 74.2 110.895 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -135.7 173.93 11.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 72.11 110.876 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 60.42 170.06 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 75.21 110.88 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.4 t 63.49 111.65 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 74.14 111.122 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -169.33 148.04 3.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 75.13 110.915 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -86.85 154.37 20.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 75.24 110.891 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 12.2 m -110.4 -30.96 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 74.22 111.131 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.4 mttp -77.47 63.16 2.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 75.41 110.924 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.7 mp 60.54 110.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.142 -0.481 . . . . 72.43 110.932 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -176.75 128.22 0.18 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 70.42 110.913 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 68.4 -69.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 72.35 110.991 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 61.79 155.5 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.005 -0.543 . . . . 64.42 110.877 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.6 pttt 43.67 66.0 5.14 Favored Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 116.105 -0.498 . . . . 74.15 111.446 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.27 141.18 31.78 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.556 2.171 . . . . 72.13 112.304 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -159.71 123.84 3.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 75.22 110.901 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -103.46 141.43 35.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 74.21 110.895 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.1 m -88.32 119.97 29.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.266 -0.425 . . . . 75.03 110.893 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.5 120.25 0.92 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 74.53 110.936 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.3 m 60.55 109.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 72.15 110.912 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -108.22 101.3 10.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 71.43 110.856 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -109.89 122.33 47.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 75.4 110.871 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 25.5 p -91.82 -33.33 15.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.209 -0.451 . . . . 72.52 110.873 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 31.2 mt 60.02 109.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 74.23 110.917 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -69.64 169.19 13.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 72.43 110.874 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 63.71 -80.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.154 -0.476 . . . . 65.02 110.977 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 147.41 66.84 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.757 -0.735 . . . . 71.1 112.52 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.85 173.04 12.54 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.553 2.168 . . . . 74.04 112.278 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -57.41 -160.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.613 2.209 . . . . 74.11 112.225 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.415 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 4.1 mttt -108.24 29.78 7.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 74.3 110.945 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.405 ' CE2' ' HB3' ' A' ' 178' ' ' ALA . 39.4 p90 -153.79 160.68 42.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.279 -0.419 . . . . 73.01 110.91 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.419 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 79.9 m -128.93 103.5 7.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.132 -0.485 . . . . 75.14 110.897 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . 0.401 ' HG2' ' N ' ' A' ' 114' ' ' SER . 5.3 tttt -103.14 144.27 31.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.317 -0.401 . . . . 75.42 111.045 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.401 ' N ' ' HG2' ' A' ' 113' ' ' LYS . 0.3 OUTLIER -139.44 120.36 14.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.161 -0.472 . . . . 73.25 110.905 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 30.6 t -75.36 106.36 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 74.25 111.288 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -80.75 -44.77 18.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 74.24 110.844 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -123.34 107.84 12.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.441 . . . . 75.11 111.049 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.5 mttm -62.44 139.58 58.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 71.22 110.803 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -106.66 -106.27 3.1 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.759 -0.734 . . . . 61.2 112.452 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -90.48 -43.8 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.965 0.412 . . . . 73.04 110.745 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 72.26 38.92 0.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.918 -0.583 . . . . 73.51 110.763 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.4 ' O ' ' CD1' ' A' ' 124' ' ' PHE . 0.8 OUTLIER -160.59 -44.76 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.007 -0.542 . . . . 64.22 110.785 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -85.17 106.32 16.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 75.23 110.873 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.4 ' CD1' ' O ' ' A' ' 122' ' ' THR . 18.2 m-85 -119.22 147.78 43.7 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.186 -0.461 . . . . 75.15 110.885 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.33 127.99 28.19 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.579 2.186 . . . . 73.13 112.303 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.0 mmtm -103.21 147.35 27.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 75.51 110.882 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 11.5 mtpt -55.64 111.25 0.86 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 73.21 111.02 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 107.42 -16.37 37.98 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.759 -0.734 . . . . 74.11 112.693 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.76 136.78 32.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.803 0.335 . . . . 74.12 110.875 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.512 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 23.9 m -70.82 171.88 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.253 -0.43 . . . . 73.33 111.302 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.636 ' O ' ' HA ' ' A' ' 163' ' ' SER . 19.9 m -156.63 145.47 11.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.773 -0.649 . . . . 75.34 110.529 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.451 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.2 117.83 23.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.683 0.278 . . . . 73.03 110.755 179.865 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.511 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.4 p -155.16 169.58 23.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.976 0.417 . . . . 74.33 111.216 -179.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.42 ' CZ2' ' HG3' ' A' ' 161' ' ' PRO . 12.3 m95 -106.36 165.62 11.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.858 -0.61 . . . . 74.34 110.074 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.462 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 39.9 p90 -161.76 136.21 6.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.041 0.448 . . . . 71.54 111.837 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.9 m -122.77 108.8 13.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.728 -0.669 . . . . 73.32 110.19 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.631 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.15 146.02 18.11 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.573 -0.823 . . . . 75.23 113.55 -179.128 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -152.28 152.53 32.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.767 0.318 . . . . 70.32 110.575 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 14.5 mt -87.52 -177.51 5.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 74.44 110.972 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -56.87 -43.44 81.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.103 -0.498 . . . . 65.42 110.939 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.1 -9.77 59.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.997 -0.547 . . . . 71.22 111.249 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 100.91 25.83 8.26 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.669 -0.777 . . . . 72.2 112.52 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.14 108.73 17.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.775 0.321 . . . . 72.13 110.864 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 39.0 t -63.67 126.4 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 74.43 111.111 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.427 ' CE2' ' HA3' ' A' ' 137' ' ' GLY . 51.7 p90 -111.83 -28.63 7.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 75.42 111.106 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -158.47 115.16 2.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.892 0.377 . . . . 74.33 111.084 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 85.5 m -132.9 106.75 7.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 72.12 110.83 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . 0.462 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 36.0 t30 -86.33 6.7 28.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.446 . . . . 72.34 111.552 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.417 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 12.4 mm -79.46 160.46 4.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.682 0.277 . . . . 74.34 110.661 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -146.29 -85.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.462 -0.335 . . . . 74.11 111.055 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 21.4 p -146.69 166.08 27.66 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.843 0.354 . . . . 73.31 110.988 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 2.9 p -73.17 139.28 46.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 72.22 110.802 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -58.52 -28.61 65.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 72.0 111.231 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.31 -30.88 54.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 73.02 111.018 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 7.3 tttp -86.39 -33.46 20.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.27 -0.423 . . . . 74.04 110.999 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.93 175.38 13.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 75.34 110.858 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.12 30.53 4.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 73.04 110.892 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 23.5 m-20 -113.12 57.43 0.67 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 71.42 110.815 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.18 127.94 6.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.139 -0.482 . . . . 73.42 110.994 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -132.09 121.62 17.86 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 74.24 110.855 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . 0.42 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 51.9 Cg_exo -54.67 150.7 34.72 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.396 2.064 . . . . 75.02 112.259 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 3.3 tt -77.89 121.13 23.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.217 -0.447 . . . . 75.5 110.49 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.636 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -99.25 121.73 41.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.945 0.402 . . . . 75.13 111.402 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 14.7 p90 -149.25 141.02 23.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.989 -0.55 . . . . 74.32 110.652 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 36.2 mttp -78.07 138.04 38.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.988 0.423 . . . . 64.41 111.151 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.8 m -87.76 149.12 4.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.84 -0.618 . . . . 71.25 111.157 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.25 24.61 74.81 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.783 -0.723 . . . . 60.21 112.635 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 5.6 m -132.94 43.26 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.867 0.365 . . . . 74.51 111.037 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.2 36.38 5.41 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 121.151 -0.547 . . . . 73.41 113.168 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 2.7 mmtm -82.47 -47.06 12.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.899 0.38 . . . . 75.3 110.997 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . 0.401 HG13 ' CE3' ' A' ' 175' ' ' TRP . 0.4 OUTLIER -119.07 -179.33 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.06 -0.518 . . . . 75.33 110.962 179.847 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.538 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -58.41 160.69 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.375 -0.375 . . . . 74.44 111.265 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -68.95 -27.91 66.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.198 -0.455 . . . . 75.31 111.259 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.21 -37.46 42.37 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.595 -0.812 . . . . 53.14 111.98 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.538 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 1.8 t90 -77.86 -33.15 52.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.985 0.421 . . . . 73.14 111.033 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -63.22 -38.58 91.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.962 -0.563 . . . . 61.01 110.636 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -75.5 -29.37 59.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.988 -0.551 . . . . 72.11 110.824 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . 0.405 ' HB3' ' CE2' ' A' ' 111' ' ' TYR . . . -79.13 -61.94 1.85 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.436 . . . . 73.25 111.32 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.5 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 6.9 mt -53.77 -33.77 56.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.028 -0.533 . . . . 75.14 111.031 -179.753 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 49.3 tp -58.84 -28.17 65.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.368 -0.378 . . . . 74.31 110.825 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 26.4 p -91.75 -2.96 56.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 71.3 111.404 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 1.1 ttp -77.7 156.63 30.55 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.79 0.329 . . . . 74.13 110.797 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -112.79 167.96 10.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 74.12 111.134 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 3.9 tttp -68.16 126.48 29.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.961 -0.563 . . . . 72.41 111.034 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.67 33.14 71.16 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.759 -0.734 . . . . 63.02 112.683 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -118.34 148.76 42.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.793 0.33 . . . . 73.44 110.849 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -117.09 139.75 50.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.297 -0.411 . . . . 74.01 110.213 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -145.65 173.86 11.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.151 0.5 . . . . 74.42 111.866 -179.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.75 114.93 10.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.585 -0.734 . . . . 73.44 109.71 179.183 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.424 ' HG ' ' CE1' ' A' ' 216' ' ' PHE . 0.9 OUTLIER -126.11 141.87 51.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.501 . . . . 62.14 112.131 -178.948 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.76 112.89 21.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.556 -0.747 . . . . 75.12 110.236 179.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.456 ' CD1' ' CZ ' ' A' ' 216' ' ' PHE . 3.7 mp -101.09 143.48 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.971 0.415 . . . . 75.42 111.637 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.414 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.1 mt-10 -79.99 167.71 31.54 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 73.41 110.59 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . 0.414 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 18.8 Cg_endo -60.36 -44.03 30.55 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.45 2.1 . . . . 71.1 112.257 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.03 -25.27 11.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 73.23 111.296 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . 0.415 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 7.4 m0 -118.02 36.95 4.13 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.472 -0.331 . . . . 74.33 111.097 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -155.25 -83.59 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 62.02 111.357 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.441 ' CE2' ' CD1' ' A' ' 214' ' ' LEU . 35.6 m-85 -105.59 -27.91 11.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.898 0.38 . . . . 75.15 110.84 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 105.38 176.8 24.22 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.832 -0.699 . . . . 74.2 112.789 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -60.23 -34.65 73.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.79 0.328 . . . . 75.53 110.858 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -49.49 77.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 73.24 110.707 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.34 -158.65 14.21 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.839 -0.696 . . . . 71.12 112.605 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . 0.428 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.0 OUTLIER -149.77 83.64 6.23 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 120.82 0.343 . . . . 63.14 110.518 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.39 -43.6 43.35 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.725 2.284 . . . . 75.5 112.727 -179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.64 -42.13 70.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.889 0.376 . . . . 71.44 111.036 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -96.95 26.73 4.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.043 -0.526 . . . . 65.42 111.299 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.19 31.13 4.8 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.405 -0.361 . . . . 72.33 111.091 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . 0.423 HG13 ' CE2' ' A' ' 198' ' ' TYR . 18.5 mm -95.72 111.72 56.71 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 74.22 111.19 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.29 161.3 43.19 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.407 2.071 . . . . 64.02 112.214 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_exo -51.62 118.62 4.6 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.489 2.126 . . . . 74.33 112.292 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 65.07 72.5 0.43 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.226 -0.443 . . . . 72.54 110.849 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -122.33 151.64 40.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 72.34 111.256 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 5.6 tptt -88.7 148.12 24.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.074 -0.512 . . . . 74.2 110.45 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.441 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 8.2 mt -129.86 109.41 10.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.839 0.352 . . . . 73.45 111.363 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 58.5 m -106.97 138.92 42.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.062 -0.517 . . . . 74.42 110.786 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.631 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 9.0 p90 -161.8 -175.4 4.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.265 -0.425 . . . . 64.35 111.053 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.65 147.96 33.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 73.32 110.807 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 1.5 t -125.89 153.36 33.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.98 -0.555 . . . . 71.13 112.025 -178.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -133.93 106.11 7.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.846 -0.615 . . . . 75.24 110.031 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . 0.511 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 1.3 tt -69.93 130.97 43.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.406 -0.361 . . . . 62.4 110.996 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . 0.402 ' N ' HD23 ' A' ' 220' ' ' LEU . 28.1 t -109.3 -29.72 2.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.17 -0.468 . . . . 75.22 111.466 -179.708 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -171.11 161.67 6.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.869 0.366 . . . . 74.2 111.267 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 39.3 mt -141.96 111.45 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.087 -0.506 . . . . 74.04 110.99 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 74.4 110.899 179.979 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.843 0.354 . . . . 71.14 111.183 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 61.14 154.99 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 62.24 111.081 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.36 24.72 1.92 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 73.41 111.254 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -173.99 168.44 4.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.842 0.353 . . . . 73.41 111.24 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.1 t -124.02 116.09 27.49 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.102 -0.499 . . . . 73.14 111.063 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.446 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 72.0 Cg_endo -77.18 137.75 17.38 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.708 2.272 . . . . 75.21 112.456 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -82.35 148.1 28.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 72.44 110.76 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.89 97.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 74.34 111.207 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.95 -16.36 63.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.482 . . . . 75.42 111.397 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.429 ' CZ3' ' HA ' ' A' ' 25' ' ' ILE . 4.1 m-90 -129.44 161.87 29.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.948 0.404 . . . . 74.42 110.812 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.5 m -100.48 150.02 23.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.873 -0.603 . . . . 71.3 110.148 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.453 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 46.3 t -56.85 -36.84 51.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.958 0.409 . . . . 62.24 110.47 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 17' ' ' SER . 3.7 pt-20 -69.1 -22.71 63.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.814 -0.63 . . . . 73.0 110.852 179.366 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 17' ' ' SER . 26.0 mt-30 -82.03 -54.49 5.26 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.358 -0.383 . . . . 75.53 111.174 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.1 mt -50.11 -66.38 0.4 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 71.2 111.782 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 12' ' ' VAL . 2.5 ptm180 -59.4 -25.23 64.12 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 120.957 -0.297 . . . . 75.31 111.242 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.425 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 0.2 OUTLIER -52.03 179.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.919 0.39 . . . . 71.31 111.144 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -110.36 16.43 21.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.055 -0.521 . . . . 73.32 111.199 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.85 -23.75 8.48 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.497 -0.32 . . . . 74.42 111.184 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -80.67 117.2 66.78 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.454 -0.339 . . . . 74.12 110.856 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.85 123.65 11.62 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.466 2.11 . . . . 72.22 112.425 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -27.82 69.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.112 -0.495 . . . . 72.34 111.278 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -53.47 -39.51 64.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.909 0.385 . . . . 75.42 111.122 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.53 -53.65 9.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.059 -0.519 . . . . 73.24 110.658 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.45 HG21 HD11 ' A' ' 25' ' ' ILE . 36.2 mt -45.63 -33.63 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.799 -0.637 . . . . 74.12 111.342 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 6.0 mt -76.02 -40.21 37.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 65.21 111.037 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -69.43 -23.53 63.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.03 -0.532 . . . . 73.45 111.263 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.451 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 22.9 t80 -74.84 -46.4 36.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.964 0.411 . . . . 75.52 111.124 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.5 mt -69.03 -24.67 64.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.963 -0.562 . . . . 74.51 111.185 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -80.2 -28.37 38.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.387 -0.37 . . . . 73.14 110.98 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -94.29 -41.06 9.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.297 -0.41 . . . . 64.31 111.113 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.451 ' ND1' ' CZ ' ' A' ' 28' ' ' PHE . 11.7 m170 -90.3 -7.32 53.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.301 -0.408 . . . . 75.35 111.477 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.8 164.83 12.99 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.698 -0.763 . . . . 53.22 112.401 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.3 p -92.43 148.39 22.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.671 0.272 . . . . 74.25 110.614 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -48.66 -57.08 6.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.785 0.326 . . . . 72.24 111.012 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.65 -50.72 31.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 74.24 110.706 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.511 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 19.8 t80 -53.78 -47.97 70.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.751 -0.659 . . . . 75.41 110.287 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 14.9 mt -63.83 -41.57 97.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.901 -0.591 . . . . 73.52 110.763 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -47.55 -40.21 18.35 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.2 -0.455 . . . . 72.14 111.095 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -48.59 -48.78 38.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.864 -0.607 . . . . 75.12 110.972 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -103.45 13.64 33.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 75.12 111.223 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 58.17 43.38 20.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.837 0.351 . . . . 71.02 110.894 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 20.4 mt -95.22 -20.91 18.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 74.55 111.615 -179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.97 158.32 32.1 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.007 0.432 . . . . 63.2 111.127 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.76 -124.23 6.1 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.978 -0.629 . . . . 73.44 112.42 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -116.3 121.18 41.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.783 0.325 . . . . 74.01 110.945 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.4 mp -46.76 -50.53 5.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.223 -0.444 . . . . 73.45 111.335 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mttm -50.41 -38.64 43.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.923 -0.581 . . . . 74.3 110.753 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -85.57 -26.3 26.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.881 -0.599 . . . . 74.2 110.9 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.0 t -79.2 -26.22 12.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.28 -0.418 . . . . 74.22 111.313 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.01 -23.34 67.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.399 -0.364 . . . . 74.23 111.123 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -95.22 -28.06 15.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 74.21 110.9 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.02 33.64 2.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 72.4 110.918 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -159.54 124.51 4.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 51.14 110.962 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -83.85 171.09 13.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 71.4 110.755 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.27 -57.92 9.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.391 . . . . 75.21 110.599 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.32 -26.19 67.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.985 -0.552 . . . . 63.35 110.435 179.338 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -45.18 93.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.995 -0.548 . . . . 74.21 110.492 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 24.6 mt -74.68 -29.14 61.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.695 -0.684 . . . . 73.15 111.101 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 5.9 t -79.71 -43.52 23.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.972 0.415 . . . . 64.24 110.885 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.7 m -61.0 -34.99 75.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.911 -0.586 . . . . 72.31 110.761 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.437 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -81.33 -23.39 37.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 72.3 111.073 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -83.74 -22.79 31.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 74.32 110.945 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.1 m-20 -83.42 -54.61 4.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 73.24 111.39 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.511 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.3 p-80 -62.59 -25.79 68.26 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.114 -0.494 . . . . 65.32 111.327 -179.411 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.441 ' HG ' ' CZ ' ' A' ' 37' ' ' PHE . 5.0 tt -53.25 -40.07 64.32 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.877 0.37 . . . . 71.41 110.935 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -78.71 -38.93 37.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.029 -0.532 . . . . 73.11 110.621 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.86 -41.26 91.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.023 -0.535 . . . . 73.4 110.772 179.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.9 p -90.85 -4.14 56.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.938 -0.574 . . . . 71.34 111.437 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.98 37.93 11.38 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.735 0.302 . . . . 73.34 111.351 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.407 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 27.0 mtt-85 -94.13 44.1 1.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.383 -0.371 . . . . 74.42 111.092 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.439 ' CD2' HD22 ' A' ' 66' ' ' LEU . 86.0 m-85 -64.32 177.75 0.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 71.23 110.832 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.3 tttt -68.1 153.03 44.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 73.24 110.913 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -112.98 91.83 0.6 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.753 -0.737 . . . . 60.24 112.565 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.1 t 42.99 92.75 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.853 0.359 . . . . 65.13 111.559 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -134.72 -45.78 0.74 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 65.52 110.991 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.1 m -135.28 138.31 43.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.986 -0.552 . . . . 64.43 110.915 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 3.8 mp -113.24 -35.62 2.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 73.22 111.135 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.0 m -177.78 178.45 0.99 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 63.24 110.902 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -170.38 140.87 1.9 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.453 . . . . 74.51 110.895 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -132.45 158.81 43.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 73.42 111.096 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.8 m -136.52 143.41 43.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 74.43 110.89 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -99.83 -41.18 7.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 74.52 110.892 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -87.31 136.32 32.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.99 -0.55 . . . . 55.42 110.918 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 28.4 t -122.78 124.66 71.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 74.31 111.078 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -140.89 -50.88 0.45 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 74.23 110.879 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -80.6 -32.03 36.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 74.32 110.926 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.5 t -86.55 89.82 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 73.11 111.153 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -141.9 90.37 2.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 75.23 110.872 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.5 tp -177.58 -39.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 75.41 110.958 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -79.85 -176.3 5.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.092 -0.504 . . . . 74.32 110.887 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -116.78 82.03 1.73 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 72.41 110.897 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -67.96 135.18 51.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 74.42 110.843 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.4 pttm -108.59 147.22 35.29 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 70.52 110.926 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.6 98.57 0.97 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.547 2.165 . . . . 74.11 112.331 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.7 tptt -159.85 145.35 15.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 71.34 110.869 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -136.11 79.16 1.75 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.147 -0.478 . . . . 73.51 110.891 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.7 p -152.86 163.27 40.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 73.32 110.914 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -104.81 -31.52 9.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 72.14 110.915 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -161.07 132.32 5.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 65.4 110.872 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -150.2 96.31 2.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 71.24 110.895 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -149.72 120.79 7.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 74.0 110.931 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.5 m 60.33 92.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 73.44 110.862 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -148.17 108.5 4.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 73.31 110.91 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -159.47 -45.08 0.05 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 74.25 110.897 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -159.46 78.27 0.71 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.075 -0.511 . . . . 73.22 110.888 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.25 88.45 1.91 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.714 -0.755 . . . . 51.33 112.498 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.94 170.81 15.92 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.532 2.155 . . . . 73.44 112.304 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.62 -178.87 2.49 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.583 2.188 . . . . 65.34 112.252 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.418 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 1.8 mptt -113.68 29.24 8.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 74.14 110.957 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.409 ' CE1' ' HB2' ' A' ' 177' ' ' GLU . 34.3 p90 -151.99 152.36 32.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.207 -0.451 . . . . 73.23 110.886 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 62.9 m -124.08 103.62 8.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 62.03 110.947 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt -97.09 151.34 19.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.445 . . . . 75.24 110.834 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.403 ' O ' ' CD2' ' A' ' 116' ' ' LEU . 1.4 t -148.69 118.62 7.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.248 -0.433 . . . . 72.34 111.018 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 40.7 t -78.62 106.33 9.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.461 . . . . 72.11 111.242 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.403 ' CD2' ' O ' ' A' ' 114' ' ' SER . 3.2 mm? -81.8 -41.26 21.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.419 . . . . 75.21 110.7 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 8.2 ttpp -125.51 109.15 12.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 75.11 111.008 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.4 mttp -61.14 139.44 58.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 74.44 110.937 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -97.33 -108.3 2.59 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.802 -0.713 . . . . 65.51 112.478 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -96.42 -37.32 10.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.967 0.413 . . . . 73.51 110.7 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.4 36.87 0.61 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.885 -0.598 . . . . 74.42 110.911 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 58.8 m -163.09 -43.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 71.34 111.086 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -81.81 86.05 6.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.286 -0.416 . . . . 74.32 111.158 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -102.74 143.36 26.45 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 75.42 110.743 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.51 130.96 43.36 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.559 2.173 . . . . 74.51 112.575 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.12 147.31 24.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 72.55 110.735 179.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -53.3 116.94 2.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.329 -0.396 . . . . 75.52 111.139 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 93.8 -4.27 71.86 Favored Glycine 0 CA--C 1.519 0.326 0 C-N-CA 120.732 -0.747 . . . . 73.52 112.876 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.21 139.5 30.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.869 0.366 . . . . 70.0 110.972 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.432 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 7.8 p -69.39 162.23 3.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 72.43 111.055 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.614 ' O ' ' HA ' ' A' ' 163' ' ' SER . 13.4 m -154.86 145.95 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 73.13 111.031 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.463 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -128.08 117.97 22.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.722 0.296 . . . . 75.24 110.951 179.909 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.408 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 22.9 p -151.36 166.76 30.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.92 0.39 . . . . 75.24 111.216 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.429 ' CE2' ' HG3' ' A' ' 161' ' ' PRO . 15.8 m95 -100.93 160.9 13.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.017 -0.538 . . . . 71.43 109.961 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.463 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 17.4 p90 -161.28 138.1 8.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.917 0.389 . . . . 74.31 111.632 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 3.5 m -126.33 109.06 11.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.999 -0.546 . . . . 74.43 111.043 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.702 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -86.94 138.31 15.41 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.834 -0.698 . . . . 73.1 113.111 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.98 132.56 14.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.705 0.288 . . . . 73.4 110.522 179.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 40.8 mt -70.44 -178.37 1.73 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.381 -0.372 . . . . 74.03 110.991 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -57.15 -42.71 81.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.086 -0.507 . . . . 61.21 110.774 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -76.03 -3.08 33.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.935 -0.575 . . . . 71.12 111.493 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 90.67 8.39 65.63 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.629 -0.796 . . . . 74.2 112.91 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.01 110.01 11.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.785 0.326 . . . . 73.13 110.684 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 7.3 p -63.67 133.04 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.289 -0.414 . . . . 73.21 111.158 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.415 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 46.1 p90 -111.22 -29.3 7.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 72.03 110.832 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -168.21 121.8 0.9 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 70.51 110.866 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 12.5 t -142.82 128.25 18.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.37 -0.377 . . . . 74.15 111.077 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . 0.463 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 27.3 t30 -89.14 53.29 2.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.096 -0.502 . . . . 71.4 110.631 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . 3.2 mt -146.42 109.46 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 74.45 111.394 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -169.9 139.19 1.87 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.257 -0.429 . . . . 75.21 111.01 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 75.8 p -146.48 90.97 1.99 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.157 -0.474 . . . . 75.41 110.878 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 77.2 p -83.92 165.47 18.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 74.25 110.922 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -73.44 -36.19 65.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 73.14 111.093 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.08 -31.43 70.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 73.44 110.898 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.18 1.72 43.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 75.54 111.401 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.8 29.58 16.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.834 0.35 . . . . 72.42 110.962 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 57.3 87.48 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.23 -0.441 . . . . 75.34 110.952 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 11.0 m-20 -146.78 104.2 3.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 73.22 110.891 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -127.64 138.99 53.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 42.21 111.116 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 161' ' ' PRO . 23.4 mttm -138.52 134.69 17.54 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 74.11 110.776 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . 0.429 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 31.1 Cg_exo -58.76 152.18 58.7 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.378 2.052 . . . . 64.45 112.351 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.62 125.56 29.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 72.13 110.306 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.614 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.66 122.91 43.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.991 0.424 . . . . 73.44 111.585 -179.66 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -151.31 143.62 24.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.859 -0.609 . . . . 74.32 110.516 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 34.6 mttt -81.7 142.0 33.08 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 75.33 111.043 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.5 m -87.69 149.03 4.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.897 -0.592 . . . . 74.33 111.285 -179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 67.91 25.11 74.36 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.851 -0.69 . . . . 70.52 112.592 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 27.3 m -131.3 41.11 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.788 0.327 . . . . 75.43 111.174 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.22 35.25 2.49 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 121.194 -0.527 . . . . 73.23 113.151 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.69 -43.55 15.43 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.794 0.331 . . . . 74.13 111.178 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.8 m -119.14 179.38 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.166 -0.47 . . . . 61.44 111.147 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.527 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.4 163.61 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 73.41 111.217 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . 0.419 ' HD3' ' CZ2' ' A' ' 196' ' ' TRP . 14.7 ttm105 -70.13 -29.75 66.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.234 -0.439 . . . . 74.3 111.227 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.36 -36.49 49.86 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.603 -0.808 . . . . 74.12 112.02 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.527 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 1.7 t90 -79.76 -34.34 39.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.052 0.453 . . . . 74.02 110.874 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -62.82 -33.28 74.9 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.751 -0.659 . . . . 74.0 110.403 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . 0.409 ' HB2' ' CE1' ' A' ' 111' ' ' TYR . 3.9 mm-40 -80.77 -29.09 36.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.527 . . . . 71.13 110.68 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -78.8 -61.93 1.86 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.445 . . . . 73.23 111.175 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.468 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 10.1 mt -53.65 -28.14 31.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.967 -0.56 . . . . 64.44 110.794 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 1.1 tp -53.38 -29.75 36.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.115 -0.493 . . . . 74.3 111.272 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 60.2 p -108.87 7.7 26.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.382 -0.372 . . . . 64.22 111.7 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 26.7 mmm -69.78 106.03 2.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.889 0.376 . . . . 70.33 110.884 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.09 150.25 48.46 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.969 -0.56 . . . . 74.14 111.036 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.12 119.94 6.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.56 . . . . 62.02 110.9 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 74.97 20.33 79.5 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.705 -0.76 . . . . 74.15 112.431 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -96.95 143.41 27.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.846 0.355 . . . . 63.23 111.081 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt -110.45 132.9 53.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.061 -0.518 . . . . 74.33 109.787 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -143.08 171.52 13.96 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.235 0.54 . . . . 74.34 112.09 -179.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . 0.425 ' HA ' ' HA ' ' A' ' 217' ' ' GLU . 0.0 OUTLIER -137.09 117.6 13.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.299 -0.864 . . . . 74.22 109.504 179.587 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.446 ' CD2' ' CE2' ' A' ' 216' ' ' PHE . 2.2 pt? -127.6 141.23 51.68 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.212 -0.595 . . . . 73.44 112.545 -178.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -113.59 116.12 29.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.271 -0.877 . . . . 74.43 109.864 179.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . 0.403 HG12 ' CE1' ' A' ' 216' ' ' PHE . 4.5 mm -91.42 144.81 8.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.857 0.36 . . . . 62.32 111.372 -179.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -84.47 154.49 62.53 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.069 -0.514 . . . . 74.41 110.481 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . 0.415 ' O ' ' N ' ' A' ' 199' ' ' GLY . 63.7 Cg_exo -51.07 -44.2 43.76 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.458 2.105 . . . . 72.42 112.376 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -62.36 -19.74 63.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 74.02 111.629 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . 0.419 ' CZ2' ' HD3' ' A' ' 173' ' ' ARG . 6.3 m0 -118.55 37.1 4.16 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.64 0.257 . . . . 71.5 111.528 -179.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -156.19 -84.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.634 -0.257 . . . . 74.34 111.581 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.454 ' CE2' ' CD1' ' A' ' 208' ' ' ILE . 19.6 m-85 -104.96 -26.19 12.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.853 0.359 . . . . 74.41 111.061 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 194' ' ' PRO . . . 105.85 163.33 23.17 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.833 -0.699 . . . . 70.22 112.474 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 28.7 mtmt -55.49 -30.91 61.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.825 0.345 . . . . 75.53 110.824 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 18.8 mtpt -61.21 -48.53 81.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 73.14 110.795 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 106.72 166.32 22.53 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.836 -0.697 . . . . 40.03 112.487 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . 0.429 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.7 OUTLIER -110.68 90.02 10.0 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.701 0.286 . . . . 75.23 110.832 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.17 -21.59 55.21 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.459 2.106 . . . . 73.54 112.409 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.46 -41.6 85.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.318 -0.401 . . . . 64.42 110.923 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -108.11 27.33 9.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.061 -0.518 . . . . 62.32 111.199 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 56.16 54.44 7.82 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.429 . . . . 74.42 111.108 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . 0.454 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 27.1 mt -117.35 111.63 39.98 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 74.4 111.06 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -60.68 157.76 35.84 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.525 2.15 . . . . 55.41 112.373 -179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.17 130.52 32.67 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.651 2.234 . . . . 75.34 112.142 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 64.09 69.6 0.53 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.337 -0.392 . . . . 74.11 110.873 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -122.87 149.23 44.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.216 -0.447 . . . . 72.33 111.261 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -83.94 149.77 26.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.03 -0.532 . . . . 74.43 110.554 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.453 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 7.2 mt -136.19 109.35 7.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.89 0.376 . . . . 74.02 111.576 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 45.7 m -109.95 138.23 46.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 74.24 110.184 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.702 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 12.4 p90 -157.79 120.36 3.83 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 112.386 0.513 . . . . 75.52 112.386 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 189' ' ' ARG . 2.6 mt-10 -74.17 136.46 42.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.628 -0.714 . . . . 64.23 110.654 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 3.3 t -122.41 150.89 26.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.077 -0.511 . . . . 75.35 111.525 -178.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -136.77 110.18 7.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.039 -0.528 . . . . 70.34 110.491 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . 0.408 ' HA ' ' HB3' ' A' ' 133' ' ' CYS . 3.5 tt -70.53 132.16 45.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.404 -0.362 . . . . 74.3 111.145 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 30.8 t -109.68 -30.69 2.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.103 -0.499 . . . . 64.4 111.429 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -168.94 159.3 9.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.875 0.369 . . . . 75.24 111.107 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 29.2 mt -142.25 112.01 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 71.31 111.157 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 73.33 110.826 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mtt . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.847 0.356 . . . . 74.3 111.163 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.15 132.99 49.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 50.01 111.05 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.96 98.69 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.225 -0.443 . . . . 53.43 111.008 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 167.07 89.57 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.209 -0.45 . . . . 72.45 111.105 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.7 t -90.38 110.05 38.08 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.437 -0.347 . . . . 65.2 110.84 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.452 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 93.0 Cg_endo -79.21 135.06 11.88 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.533 2.155 . . . . 74.42 112.46 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -80.31 150.63 29.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.181 -0.463 . . . . 75.3 110.803 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.13 96.03 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.184 -0.462 . . . . 75.42 111.209 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.63 -16.46 64.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 74.13 111.396 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 6.0 m-90 -136.0 173.67 11.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.848 0.356 . . . . 73.34 110.789 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -116.79 152.11 35.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.113 -0.494 . . . . 74.13 110.597 179.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.2 t -55.88 -32.74 33.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.264 -0.425 . . . . 75.43 110.928 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -72.33 -26.65 62.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.992 -0.549 . . . . 73.33 111.202 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -82.19 -56.44 3.92 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.842 0.353 . . . . 65.32 111.056 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 mt -49.58 -65.43 0.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.301 -0.409 . . . . 71.21 111.328 -179.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.7 mtp-105 -55.75 -25.09 39.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 73.32 111.356 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.4 -179.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.01 0.434 . . . . 63.15 111.175 -179.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -109.41 16.76 22.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.937 -0.574 . . . . 60.41 111.108 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -114.51 -27.86 7.39 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.485 -0.325 . . . . 75.44 111.097 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -81.94 112.61 36.6 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.392 . . . . 71.4 110.954 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -60.66 123.34 12.82 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.52 2.146 . . . . 65.3 112.364 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -24.15 67.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 75.54 111.192 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -53.61 -40.53 65.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.886 0.374 . . . . 75.41 111.232 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.98 -52.5 14.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.092 -0.504 . . . . 75.01 110.728 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.44 HG23 HD12 ' A' ' 25' ' ' ILE . 42.8 mt -44.87 -30.74 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.707 -0.679 . . . . 74.31 111.295 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.3 mt -81.76 -55.2 8.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.053 0.454 . . . . 74.14 110.765 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -52.44 -27.12 14.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.687 -0.688 . . . . 74.42 110.935 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.454 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 42.7 t80 -77.24 -48.63 17.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.075 -0.511 . . . . 74.21 110.969 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.3 mt -67.13 -26.44 66.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.859 -0.609 . . . . 74.23 111.336 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -75.3 -35.66 61.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.942 0.401 . . . . 74.35 110.717 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.42 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 14.9 pt-20 -87.63 -31.19 19.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 71.33 111.075 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.454 ' ND1' ' CZ ' ' A' ' 28' ' ' PHE . 19.7 m170 -98.95 -9.02 24.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.289 -0.414 . . . . 75.31 111.571 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -109.86 155.65 15.98 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.719 -0.753 . . . . 63.24 112.318 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.3 p -97.3 153.11 18.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.562 0.22 . . . . 71.45 110.539 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.403 ' HA ' HD23 ' A' ' 44' ' ' LEU . 0.8 OUTLIER -42.89 -48.57 5.84 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.847 0.356 . . . . 74.24 111.371 -179.702 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.6 m -52.85 -50.89 62.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.123 -0.489 . . . . 73.34 110.507 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.429 ' CZ ' HD11 ' A' ' 66' ' ' LEU . 1.1 t80 -60.47 -31.95 70.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.623 -0.717 . . . . 73.33 110.355 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.45 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 5.9 mt -75.86 -54.75 6.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.004 -0.543 . . . . 73.03 111.307 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.02 -35.0 23.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.351 -0.386 . . . . 64.43 111.751 -179.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -72.64 -31.13 64.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.242 -0.435 . . . . 71.01 111.523 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.432 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 1.8 m170 -109.91 10.33 24.39 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.734 0.272 . . . . 63.12 111.734 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.407 ' N ' ' O ' ' A' ' 38' ' ' LEU . 7.7 mmmt 58.43 35.63 24.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.745 0.307 . . . . 72.0 111.217 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.413 ' CB ' ' CD2' ' A' ' 38' ' ' LEU . 49.4 mt -90.96 -16.93 27.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.427 -0.352 . . . . 75.31 111.017 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.45 ' N ' ' HB3' ' A' ' 38' ' ' LEU . 56.7 mt -50.76 170.46 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.042 0.449 . . . . 71.43 111.32 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.23 -155.94 29.04 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.927 -0.654 . . . . 63.41 112.951 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 72.9 m-80 -100.57 141.88 32.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.968 0.413 . . . . 74.14 111.051 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 mp -45.31 -47.24 3.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.883 -0.598 . . . . 73.11 111.526 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mttm -51.61 -41.58 61.34 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.983 -0.553 . . . . 71.1 111.065 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -85.7 -28.35 24.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.013 -0.54 . . . . 73.33 111.113 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.3 t -74.0 -27.72 22.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.278 -0.419 . . . . 75.52 111.535 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.45 -24.1 67.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.386 -0.37 . . . . 75.33 111.434 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -95.24 -27.3 15.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.341 -0.391 . . . . 71.51 111.28 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.7 m -84.19 -24.38 30.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.362 -0.381 . . . . 72.24 111.403 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -116.57 132.7 56.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.842 0.354 . . . . 73.44 111.31 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -79.71 -178.61 6.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.126 -0.488 . . . . 72.31 110.409 179.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -60.96 -58.46 8.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.788 0.328 . . . . 73.34 110.494 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.29 -30.18 71.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.211 -0.45 . . . . 75.14 110.512 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.35 -39.64 80.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.5 . . . . 73.03 110.443 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.5 mt -79.36 -27.36 41.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.588 -0.733 . . . . 75.13 111.022 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 10.9 t -79.9 -44.26 22.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.969 0.414 . . . . 63.51 110.774 179.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 79.2 m -60.61 -35.8 77.02 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.896 -0.593 . . . . 70.5 110.236 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.432 ' HA ' ' CE1' ' A' ' 41' ' ' HIS . . . -78.7 -23.19 45.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.855 -0.611 . . . . 75.21 110.774 179.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -82.97 -22.74 33.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.086 -0.506 . . . . 75.41 111.016 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -85.47 -53.73 5.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 75.44 111.242 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -63.33 -24.35 67.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.008 -0.542 . . . . 63.45 111.408 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.442 HD21 ' CD2' ' A' ' 72' ' ' PHE . 6.3 tt -56.06 -39.1 71.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.92 0.39 . . . . 75.41 110.904 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.402 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.4 m-85 -77.85 -40.69 39.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.975 -0.557 . . . . 64.11 110.613 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -66.37 -37.73 85.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.542 . . . . 65.52 110.711 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 75.5 p -91.13 -7.25 52.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.964 -0.562 . . . . 74.42 111.329 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.8 mtmt 51.21 35.43 13.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.739 0.304 . . . . 74.24 111.438 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 41.9 mtt-85 -91.93 44.4 1.17 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.374 -0.375 . . . . 73.42 111.146 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.442 ' CD2' HD21 ' A' ' 66' ' ' LEU . 88.9 m-85 -65.72 176.53 1.51 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.288 -0.414 . . . . 74.41 110.701 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -77.11 134.38 38.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 74.24 110.897 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -112.22 -146.24 10.02 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.738 -0.744 . . . . 71.05 112.454 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.5 t -100.01 147.63 25.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.812 0.339 . . . . 73.45 110.865 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -110.05 -33.43 6.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.445 . . . . 73.43 110.908 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 11.4 t -173.74 129.0 0.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 70.15 110.919 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 2.5 pp -157.26 146.25 10.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 74.5 111.09 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.4 m 60.31 -169.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 75.03 110.876 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.97 101.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 74.52 110.883 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.9 p -109.22 -31.08 2.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.45 . . . . 62.34 111.098 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 53.1 p -60.76 -41.99 96.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 74.42 110.895 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 63.64 138.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.218 -0.446 . . . . 73.1 110.914 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 60.72 111.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.471 . . . . 74.33 110.918 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.4 t -127.93 130.25 69.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 75.44 111.129 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.66 -51.58 4.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.46 . . . . 70.4 110.869 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -177.48 -39.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 70.45 110.889 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 28.9 t -66.97 107.04 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.076 -0.511 . . . . 75.23 111.036 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 6.7 tptt -136.22 88.73 2.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 72.12 110.901 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.2 mp -88.49 164.09 15.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 72.4 110.897 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 60.44 107.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 72.41 110.902 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.79 -32.79 21.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 74.43 110.898 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -102.66 101.09 11.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 74.22 110.887 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.2 tttm -105.82 87.48 2.36 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 75.32 110.931 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.79 165.83 29.68 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.595 2.197 . . . . 65.1 112.293 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.24 128.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 73.23 110.946 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 61.02 31.91 19.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 75.23 110.929 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 5.6 m -163.73 105.08 0.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 73.12 110.911 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.3 mttt 60.55 172.92 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 74.22 110.914 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.1 p -152.78 147.22 25.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 73.04 110.871 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -96.55 -32.54 12.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 71.43 110.888 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 60.34 164.29 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 71.52 110.877 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 2.5 p -146.6 122.64 10.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 63.3 110.88 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 7.1 mt -95.21 134.05 38.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 75.32 110.918 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -93.32 179.46 5.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 75.42 110.884 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 63.71 -80.15 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.179 -0.464 . . . . 74.13 110.996 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 148.35 66.9 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.872 -0.68 . . . . 53.05 112.532 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.88 170.81 15.84 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.577 2.185 . . . . 74.24 112.306 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.07 -167.65 0.18 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.596 2.197 . . . . 64.24 112.29 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -100.76 29.9 4.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 71.45 110.955 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -154.82 167.33 30.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.285 -0.416 . . . . 73.43 111.015 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 82.0 m -136.72 103.52 5.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.016 -0.538 . . . . 75.51 110.725 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 190' ' ' LEU . 21.5 ptmt -108.14 151.45 25.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.948 0.404 . . . . 73.35 111.196 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -142.49 123.16 14.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.952 -0.567 . . . . 74.32 110.547 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 9.1 p -77.56 106.24 7.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.284 -0.417 . . . . 75.13 111.173 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -77.73 -42.18 35.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 71.13 110.855 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.3 tttm -130.46 108.18 9.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 70.44 110.962 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 138.28 57.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 72.42 110.844 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.5 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -109.22 -156.19 17.01 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.631 -0.795 . . . . 75.22 112.645 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -36.53 -51.21 0.83 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.919 0.39 . . . . 73.43 111.651 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 66.99 34.58 5.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.836 -0.62 . . . . 75.55 110.296 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 55.1 m -151.88 -44.06 0.11 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.697 -0.683 . . . . 72.14 110.66 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -91.5 92.65 8.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 74.43 110.903 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -100.74 153.66 37.61 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 73.35 110.791 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -71.88 125.55 11.12 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.52 2.147 . . . . 70.31 112.443 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.0 mtmm -95.54 156.9 16.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.113 -0.494 . . . . 73.24 110.956 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.8 mttp -57.88 118.71 5.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 74.33 110.865 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 99.24 -23.44 36.29 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.643 -0.789 . . . . 74.33 112.507 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -78.6 136.91 37.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.746 0.308 . . . . 73.11 110.738 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.565 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 17.1 m -73.12 173.46 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.107 0.479 . . . . 73.42 111.655 -179.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.639 ' O ' ' HA ' ' A' ' 163' ' ' SER . 19.4 m -156.78 145.87 11.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.507 -0.769 . . . . 74.51 110.568 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.444 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.3 OUTLIER -126.16 117.72 23.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.639 0.257 . . . . 74.13 110.454 179.506 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 31.9 p -150.8 169.91 20.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.104 0.478 . . . . 63.05 111.512 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' TRP . . . . . 0.488 ' HB3' ' CD1' ' A' ' 149' ' ' ILE . 85.6 m95 -101.88 156.35 17.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.559 -0.746 . . . . 75.11 109.531 179.246 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 31.8 p90 -161.27 137.66 8.34 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 120.314 -0.554 . . . . 74.21 112.304 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 12.8 m -127.88 111.56 13.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.485 -0.779 . . . . 63.41 110.195 179.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . 0.526 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.52 145.54 17.88 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.577 -0.821 . . . . 74.01 113.13 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' THR . . . . . 0.431 ' N ' ' CE2' ' A' ' 145' ' ' PHE . 0.6 OUTLIER -150.71 153.02 34.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.8 0.334 . . . . 70.53 110.893 179.834 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 69.5 mt -92.07 179.23 5.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.01 110.757 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -57.04 -44.4 82.9 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.961 0.41 . . . . 74.13 110.996 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.01 -8.54 56.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.968 -0.56 . . . . 73.42 111.313 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 95.94 25.81 12.47 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.644 -0.789 . . . . 71.21 112.523 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.89 112.59 24.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.836 0.35 . . . . 72.31 110.777 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 4.6 m -63.7 135.08 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 74.34 111.142 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.431 ' CE2' ' N ' ' A' ' 138' ' ' THR . 39.9 p90 -116.27 -39.39 3.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.49 . . . . 72.14 110.882 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -143.41 110.3 5.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.042 -0.526 . . . . 72.52 110.751 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 67.3 m -142.82 107.57 4.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 73.42 111.138 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -97.74 35.42 1.69 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 74.45 110.477 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.488 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 20.2 mm -100.79 104.49 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.08 -0.509 . . . . 72.44 111.095 -179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -107.32 -79.27 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 72.44 110.946 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 3.1 p -146.56 166.02 27.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.33 -0.395 . . . . 73.05 110.953 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.81 166.78 22.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.456 . . . . 74.12 110.878 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -80.91 -31.21 35.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 71.15 111.127 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt -63.85 -33.43 75.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 74.33 110.937 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.1 mttm -75.31 -32.99 61.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 75.34 110.884 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 5.5 tptt -172.69 167.91 5.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 75.3 110.872 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -99.48 30.62 3.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 74.1 110.992 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 21.4 m-20 -113.24 31.23 6.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.476 . . . . 74.11 110.86 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.22 129.84 7.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 74.11 111.056 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 6.5 mttm -146.38 149.53 37.97 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 73.13 110.959 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.07 155.73 68.16 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.603 2.202 . . . . 75.5 112.223 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.66 123.64 24.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 72.11 110.692 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.639 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.5 OUTLIER -104.81 124.5 49.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.895 0.378 . . . . 74.21 111.083 179.866 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' PHE . . . . . 0.422 ' CE1' HG23 ' A' ' 171' ' ' VAL . 16.3 p90 -151.26 142.14 22.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 75.13 110.906 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 33.0 mttt -74.24 133.75 42.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.431 . . . . 75.43 111.174 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.0 m -87.76 149.35 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.863 -0.608 . . . . 74.55 111.085 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 69.28 22.07 76.08 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.777 -0.725 . . . . 74.0 112.608 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 11.8 m -132.38 44.16 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.904 0.383 . . . . 60.33 111.059 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.17 36.36 4.02 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.171 -0.537 . . . . 51.2 113.223 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.59 -47.1 14.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.96 0.409 . . . . 73.33 110.881 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . 0.422 HG23 ' CE1' ' A' ' 164' ' ' PHE . 0.0 OUTLIER -119.37 -178.66 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.98 -0.554 . . . . 73.11 110.895 179.778 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' ILE . . . . . 0.531 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 4.2 pt -58.16 159.58 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.333 -0.394 . . . . 72.34 111.143 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -68.56 -29.61 68.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.347 -0.388 . . . . 75.44 111.152 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -72.57 -38.39 57.55 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.542 -0.837 . . . . 75.03 111.888 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 175' ' ' TRP . . . . . 0.531 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 2.0 t90 -77.65 -32.54 53.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.865 0.365 . . . . 75.45 110.94 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -62.61 -34.46 77.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.08 -0.509 . . . . 71.51 110.305 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -78.41 -29.86 47.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.993 -0.549 . . . . 71.31 110.679 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -78.78 -59.07 2.93 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.163 -0.472 . . . . 73.31 111.293 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.471 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 4.6 mt -57.83 -30.78 66.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.986 -0.552 . . . . 75.42 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 34.4 tp -59.47 -31.01 68.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.39 -0.368 . . . . 74.15 110.84 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.86 1.78 56.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 74.13 111.358 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.48 150.43 36.66 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.834 0.349 . . . . 72.22 110.927 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.57 165.63 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.248 -0.433 . . . . 71.34 111.22 -179.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.03 117.93 6.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.998 -0.546 . . . . 64.42 110.764 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 185' ' ' GLY . . . . . 0.405 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 69.35 65.95 2.42 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.678 -0.772 . . . . 75.32 112.272 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . 0.5 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 28.0 tt0 -144.48 145.09 31.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.62 0.248 . . . . 75.01 110.403 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt -118.63 137.02 53.57 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.21 -0.293 . . . . 74.21 110.21 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.21 173.79 11.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.18 0.514 . . . . 71.41 111.966 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.73 125.32 22.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.479 -0.782 . . . . 74.52 109.607 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . 0.412 ' HA ' ' HA ' ' A' ' 113' ' ' LYS . 1.7 pt? -137.2 143.13 42.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.274 0.559 . . . . 62.14 112.352 -179.122 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -117.13 111.01 18.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.289 -0.868 . . . . 74.45 109.862 179.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 192' ' ' ILE . . . . . . . . . . . . . 23.5 mt -104.76 141.52 20.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.024 0.44 . . . . 74.24 111.657 -179.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -74.02 163.23 69.82 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.758 -0.656 . . . . 75.11 110.947 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 194' ' ' PRO . . . . . 0.404 ' HG3' ' N ' ' A' ' 212' ' ' ALA . 48.7 Cg_exo -56.33 -36.31 96.92 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.756 2.304 . . . . 75.33 112.382 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -57.26 -42.32 81.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.26 -0.427 . . . . 72.52 111.13 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 196' ' ' TRP . . . . . 0.425 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 20.2 m0 -97.58 36.92 1.43 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 75.22 110.933 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -160.24 -79.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.989 -0.55 . . . . 73.41 110.587 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . 0.436 ' CE2' HD13 ' A' ' 208' ' ' ILE . 42.6 m-85 -105.86 -71.24 0.75 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 64.13 110.352 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.19 178.13 16.16 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.831 -0.7 . . . . 75.04 112.818 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.27 -33.51 67.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.879 0.371 . . . . 74.44 110.86 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.13 -57.02 14.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.107 -0.497 . . . . 72.42 110.633 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.17 170.19 25.02 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.862 -0.685 . . . . 75.13 112.548 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 203' ' ' GLN . . . . . 0.417 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 2.5 mm-40 -106.48 85.69 1.86 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.726 0.298 . . . . 74.23 110.698 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -63.4 -21.74 71.35 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.572 2.182 . . . . 53.32 112.554 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.59 -42.28 74.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.877 0.37 . . . . 75.35 110.876 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -97.67 28.21 3.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.096 -0.502 . . . . 71.11 111.306 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 56.01 36.51 27.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.394 -0.366 . . . . 73.3 111.013 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 208' ' ' ILE . . . . . 0.436 HD13 ' CE2' ' A' ' 198' ' ' TYR . 40.9 mt -103.94 114.24 64.69 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.151 -0.477 . . . . 72.14 111.045 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.66 171.72 10.41 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.442 2.095 . . . . 75.42 112.364 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.96 128.62 14.25 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.607 2.205 . . . . 72.41 112.426 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 16.9 m-80 64.26 69.79 0.51 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.127 -0.488 . . . . 71.13 111.0 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 212' ' ' ALA . . . . . 0.404 ' N ' ' HG3' ' A' ' 194' ' ' PRO . . . -127.85 124.91 38.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 74.05 111.493 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.19 153.94 39.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 74.55 110.365 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . 0.425 HD11 ' CD2' ' A' ' 198' ' ' TYR . 8.5 mt -131.14 109.49 10.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.947 0.403 . . . . 71.24 111.842 -179.264 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 25.4 m -100.99 135.98 41.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 75.2 110.32 179.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 216' ' ' PHE . . . . . 0.526 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 21.1 p90 -153.96 173.46 15.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.112 0.482 . . . . 74.13 111.653 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -132.61 136.37 46.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.637 -0.71 . . . . 72.13 110.426 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 218' ' ' VAL . . . . . . . . . . . . . 2.1 t -123.83 151.49 28.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.07 0.462 . . . . 72.43 111.968 -178.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -136.83 110.71 8.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.696 -0.683 . . . . 72.41 110.292 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 220' ' ' LEU . . . . . . . . . . . . . 1.7 tt -70.05 131.08 43.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 72.34 111.102 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 20.1 t -110.34 -29.21 2.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.112 -0.494 . . . . 75.53 111.452 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -170.81 161.31 7.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.917 0.389 . . . . 74.42 111.069 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 223' ' ' ILE . . . . . . . . . . . . . 42.3 mt -141.02 111.01 3.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.078 -0.51 . . . . 73.33 111.116 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 1.5 t70 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 74.2 110.907 -179.991 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.984 HG11 HG21 ' A' ' 136' ' ' THR . 38.5 t . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.667 0.27 . . . . 64.25 111.042 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.46 ' HB2' ' CE1' ' A' ' 32' ' ' HIS . 76.7 Cg_endo -77.75 137.35 15.98 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.564 2.176 . . . . 70.32 112.36 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.749 ' CD ' HD11 ' A' ' 149' ' ' ILE . 1.4 tp60 -82.41 153.66 25.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 75.31 110.87 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.8 119.91 5.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.219 -0.446 . . . . 63.54 111.072 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.498 ' HB2' ' NZ ' ' A' ' 187' ' ' LYS . . . -90.97 -34.22 15.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 42.45 110.988 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.567 ' NE1' HD11 ' A' ' 20' ' ' LEU . 1.4 m-90 -113.95 173.17 6.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.141 -0.482 . . . . 74.04 110.943 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.459 ' O ' HD12 ' A' ' 15' ' ' LEU . 4.1 m -118.4 154.5 32.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.018 -0.537 . . . . 74.51 110.719 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.408 HG13 ' CD ' ' A' ' 16' ' ' ARG . 93.1 t -57.47 -35.52 50.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.939 0.4 . . . . 73.23 110.65 179.753 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -70.19 -28.51 65.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 72.34 111.068 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -82.18 -56.79 3.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.871 0.367 . . . . 74.31 111.098 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.692 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.6 mt -49.6 -64.59 0.76 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.2 -0.454 . . . . 72.41 111.23 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.876 ' HD2' HG11 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -54.04 -25.48 21.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.49 . . . . 73.13 111.182 -179.897 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.7 173.95 0.08 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.957 0.408 . . . . 73.2 111.313 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -110.37 16.93 21.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.865 -0.607 . . . . 71.11 111.182 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -109.8 -20.83 12.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.544 -0.298 . . . . 54.34 111.218 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.763 HD22 HD11 ' A' ' 25' ' ' ILE . 10.4 tt -91.85 129.78 40.94 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.521 -0.309 . . . . 74.23 110.943 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.89 126.33 11.83 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.396 2.064 . . . . 72.45 112.309 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -24.11 67.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 72.23 111.178 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.553 ' HA ' HD12 ' A' ' 26' ' ' ILE . 26.0 mmtt -52.84 -39.25 62.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.359 -0.382 . . . . 73.54 111.374 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.39 -57.6 4.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.272 -0.422 . . . . 64.12 111.04 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.763 HD11 HD22 ' A' ' 20' ' ' LEU . 36.2 mt -44.8 -30.67 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.61 . . . . 65.11 111.479 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.662 ' HB ' HG23 ' A' ' 47' ' ' ILE . 7.1 mt -77.86 -37.33 23.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 74.12 111.008 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -75.37 -24.87 57.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.096 -0.502 . . . . 75.02 111.069 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.489 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 11.8 t80 -72.04 -44.98 62.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.971 0.415 . . . . 63.54 110.837 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.753 HD13 HD13 ' A' ' 43' ' ' LEU . 6.3 mt -68.93 -27.49 65.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 72.32 110.981 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -75.39 -26.57 58.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.271 -0.422 . . . . 70.15 111.127 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.401 ' OE2' ' CD2' ' A' ' 32' ' ' HIS . 0.6 OUTLIER -100.94 -7.2 23.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.413 -0.358 . . . . 71.34 111.317 179.953 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.489 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 10.4 m170 -118.88 -8.73 10.24 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.63 -0.259 . . . . 63.04 111.371 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -123.64 164.74 16.66 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.782 -0.723 . . . . 41.42 112.375 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.7 p -93.21 156.94 16.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.635 0.255 . . . . 71.24 110.535 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.679 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.8 p-10 -48.18 -55.4 10.5 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.745 0.307 . . . . 74.14 111.086 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.7 m -50.47 -48.14 56.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.023 0.439 . . . . 74.34 110.786 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.91 ' CZ ' HD12 ' A' ' 66' ' ' LEU . 1.6 t80 -55.83 -48.66 75.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.842 -0.617 . . . . 75.21 110.44 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.429 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 13.2 mt -66.47 -42.85 86.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.007 -0.542 . . . . 72.21 110.798 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.798 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.39 -41.87 20.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.098 0.475 . . . . 65.31 110.969 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -49.37 -51.44 34.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.623 -0.717 . . . . 74.24 111.062 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -99.95 13.22 34.65 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.98 -0.555 . . . . 70.44 111.287 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt 55.91 41.81 29.54 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.86 0.362 . . . . 74.31 110.862 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.753 HD13 HD13 ' A' ' 29' ' ' LEU . 23.3 mt -92.51 -20.45 20.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.073 -0.512 . . . . 50.31 111.491 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.798 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -80.19 157.72 26.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.122 0.487 . . . . 74.34 111.171 -179.741 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.72 -119.9 4.65 Favored Glycine 0 N--CA 1.451 -0.357 0 CA-C-N 115.608 -0.724 . . . . 61.13 112.417 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.883 ' O ' HG23 ' A' ' 50' ' ' VAL . 17.4 m-80 -116.36 115.14 25.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.72 0.295 . . . . 70.25 110.947 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.662 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.75 -57.22 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.248 -0.433 . . . . 72.11 111.365 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.3 mttt -46.71 -37.23 8.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.87 -0.604 . . . . 65.53 110.944 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -85.7 -26.24 26.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.97 -0.559 . . . . 74.2 111.019 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.6 t -81.21 -26.0 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.411 . . . . 51.11 111.371 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.63 -15.69 63.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.436 -0.347 . . . . 51.45 111.164 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.9 ttpp -95.12 -31.32 13.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.307 -0.406 . . . . 75.33 110.919 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.11 -33.63 17.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 65.43 111.142 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.68 127.25 38.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.264 -0.425 . . . . 52.23 111.163 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -83.49 175.89 9.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 73.55 110.663 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.586 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -58.21 -58.12 9.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.88 0.372 . . . . 75.35 110.595 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.43 -27.81 69.55 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.035 -0.529 . . . . 72.31 110.594 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.1 -43.88 98.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.105 -0.498 . . . . 62.43 110.511 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.648 HD21 HG12 ' A' ' 26' ' ' ILE . 21.1 mt -71.59 -34.45 69.9 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.693 -0.685 . . . . 64.02 111.06 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.876 HG11 ' HD2' ' A' ' 16' ' ' ARG . 11.1 t -76.4 -41.9 35.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.017 0.437 . . . . 63.34 110.922 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.7 m -60.54 -34.26 73.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.892 -0.595 . . . . 73.2 110.654 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.428 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -81.02 -22.12 39.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 74.31 111.138 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.682 ' HA ' HD21 ' A' ' 29' ' ' LEU . 32.4 t80 -83.59 -22.84 32.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.295 -0.412 . . . . 62.31 111.079 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -84.46 -54.24 4.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 71.42 111.49 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 3.1 p-80 -62.08 -32.9 73.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.073 -0.512 . . . . 63.23 111.288 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.91 HD12 ' CZ ' ' A' ' 37' ' ' PHE . 8.3 tt -47.69 -40.52 20.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.887 0.375 . . . . 74.43 111.201 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -78.14 -38.06 44.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.061 -0.518 . . . . 70.02 110.598 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.77 -38.45 86.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.992 -0.549 . . . . 61.15 110.823 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.1 p -87.85 -7.08 57.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 75.51 111.526 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.46 ' HZ2' ' HE1' ' A' ' 72' ' ' PHE . 0.8 OUTLIER 47.65 41.13 13.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.707 0.289 . . . . 70.5 111.556 179.61 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -107.34 46.04 0.96 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.91 0.386 . . . . 72.05 110.845 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.647 ' CD2' HD21 ' A' ' 66' ' ' LEU . 88.3 m-85 -60.58 179.07 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.014 -0.539 . . . . 74.4 110.741 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 41.2 tttm . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 61.13 110.798 179.907 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 19.8 mttt . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.81 0.338 . . . . 74.31 111.0 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.0 p90 -165.68 166.86 17.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 75.35 110.906 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' THR . . . . . 0.456 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 0.3 OUTLIER -134.03 127.66 32.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.479 . . . . 71.42 110.546 179.807 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.01 144.51 49.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.951 0.405 . . . . 74.21 111.231 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.443 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.3 m -143.16 115.34 8.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.004 -0.544 . . . . 63.42 110.71 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 24.2 t -74.61 106.27 4.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.292 -0.413 . . . . 74.33 111.331 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.443 HD12 ' O ' ' A' ' 114' ' ' SER . 6.0 mp -74.04 -63.06 1.3 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 72.45 110.758 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.6 108.07 16.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 70.23 110.878 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.78 140.79 54.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.222 -0.445 . . . . 75.35 110.98 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.509 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -112.37 -154.38 12.17 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.795 -0.717 . . . . 74.33 112.404 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -36.8 -51.9 0.9 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.956 0.408 . . . . 73.3 111.446 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.7 tttm 69.69 35.64 2.34 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.908 -0.587 . . . . 73.12 110.197 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.27 -44.76 0.09 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.702 -0.681 . . . . 73.22 110.724 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -89.08 89.44 7.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 63.42 110.843 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -97.61 154.72 37.83 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.479 . . . . 75.04 110.909 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.79 ' HB2' HG21 ' A' ' 166' ' ' VAL . 56.4 Cg_endo -70.41 125.59 11.97 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.577 2.185 . . . . 52.13 112.356 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -99.75 153.22 19.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 74.11 110.914 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.55 116.9 5.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.245 -0.434 . . . . 75.31 110.856 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 107.42 -23.21 27.21 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.715 -0.755 . . . . 71.42 112.517 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.38 139.73 30.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.771 0.319 . . . . 74.25 110.732 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.612 HG12 ' HG3' ' A' ' 165' ' ' LYS . 16.9 m -70.84 174.32 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.035 0.445 . . . . 75.52 111.432 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.874 HG22 ' O ' ' A' ' 164' ' ' PHE . 20.7 m -157.51 145.49 10.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.66 -0.7 . . . . 64.04 110.387 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.536 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -127.22 117.72 22.88 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.722 0.296 . . . . 75.42 110.683 179.815 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.491 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 27.3 p -155.2 170.86 20.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.027 0.441 . . . . 62.22 111.191 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.811 ' HB3' HD13 ' A' ' 149' ' ' ILE . 8.8 m95 -106.37 163.64 12.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.84 -0.618 . . . . 75.11 110.21 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.465 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 35.8 p90 -160.97 135.18 7.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.129 0.49 . . . . 71.41 111.751 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.984 HG21 HG11 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -124.41 110.7 14.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.612 -0.722 . . . . 74.53 110.137 179.421 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.611 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.61 144.27 17.07 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.565 -0.826 . . . . 71.32 113.468 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.844 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -151.72 130.26 12.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.681 0.277 . . . . 52.14 110.385 179.596 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.633 HD12 ' HB ' ' A' ' 143' ' ' THR . 35.3 mt -60.93 -178.32 0.1 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.445 -0.343 . . . . 73.32 110.841 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -56.04 -41.48 75.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 74.23 110.746 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -83.56 -0.57 50.94 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.979 -0.555 . . . . 75.03 111.474 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 93.79 25.79 16.75 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.64 -0.791 . . . . 62.31 112.637 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' THR . . . . . 0.633 ' HB ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -81.12 111.48 17.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.76 0.314 . . . . 72.21 110.874 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.425 HG21 ' HE3' ' A' ' 70' ' ' LYS . 34.9 t -65.59 120.91 13.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 61.2 111.17 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.443 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 35.2 p90 -112.13 -24.71 9.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 75.45 111.06 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 146' ' ' ASP . . . . . 0.414 ' HB2' ' CE1' ' A' ' 145' ' ' PHE . 28.9 m-20 -161.89 113.37 1.69 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.427 -0.351 . . . . 74.51 110.94 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.962 HG23 HG23 ' A' ' 136' ' ' THR . 90.0 m -125.29 105.58 9.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 73.42 111.04 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.465 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 27.4 t-20 -88.73 -0.62 57.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 73.31 111.27 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.811 HD13 ' HB3' ' A' ' 134' ' ' TRP . 21.7 mm . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.757 0.313 . . . . 72.14 110.913 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.775 0.321 . . . . 54.34 111.094 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -146.38 112.53 4.37 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 52.55 110.844 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 161' ' ' PRO . . . . . 0.426 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 67.1 Cg_exo -51.01 154.02 7.97 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.422 2.081 . . . . 72.42 112.328 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.428 HD23 ' HD1' ' A' ' 164' ' ' PHE . 3.2 tt -78.35 122.37 25.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 65.01 110.522 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.67 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -100.42 121.35 41.4 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.94 0.4 . . . . 74.54 111.236 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.874 ' O ' HG22 ' A' ' 131' ' ' VAL . 10.1 p90 -150.1 141.74 23.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.98 -0.555 . . . . 74.31 110.731 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.612 ' HG3' HG12 ' A' ' 130' ' ' VAL . 72.6 mttt -77.33 136.63 38.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.083 0.468 . . . . 75.23 111.201 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.79 HG21 ' HB2' ' A' ' 125' ' ' PRO . 32.0 m -87.64 149.38 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.704 -0.68 . . . . 73.54 111.185 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.83 24.09 75.65 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.912 -0.661 . . . . 73.21 112.673 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.785 HG23 ' HG2' ' A' ' 170' ' ' LYS . 14.4 m -132.27 44.77 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.914 0.388 . . . . 61.13 111.043 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.7 36.39 4.67 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 121.188 -0.529 . . . . 72.52 113.215 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 170' ' ' LYS . . . . . 0.785 ' HG2' HG23 ' A' ' 168' ' ' VAL . 3.0 mmtm -82.99 -47.11 12.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.941 0.401 . . . . 61.21 110.983 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -118.3 -179.65 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.963 -0.562 . . . . 75.2 110.992 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.542 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -58.82 159.54 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 75.33 111.23 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -68.25 -26.1 65.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 71.44 111.297 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -77.84 -37.06 30.75 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.669 -0.777 . . . . 51.13 112.198 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.599 ' CD1' HD11 ' A' ' 190' ' ' LEU . 2.4 t90 -77.3 -33.57 55.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.897 0.38 . . . . 73.33 111.17 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.96 -37.16 83.76 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.016 -0.538 . . . . 74.14 110.617 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -73.27 -30.07 63.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.016 -0.538 . . . . 64.51 110.731 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.736 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -83.4 -48.82 9.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.147 -0.479 . . . . 62.31 111.249 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.57 HD21 HG21 ' A' ' 218' ' ' VAL . 9.4 mt -63.47 -34.42 77.72 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.074 -0.512 . . . . 61.45 110.801 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 35.6 tp -55.71 -23.12 27.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 74.42 111.115 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 51.1 p -98.64 2.25 47.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.368 -0.378 . . . . 61.21 111.567 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.413 ' HE1' ' O ' ' A' ' 186' ' ' GLU . 0.0 OUTLIER -77.19 152.39 34.82 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.729 0.299 . . . . 65.44 110.737 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -115.43 161.99 17.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.31 -0.405 . . . . 45.31 111.259 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -60.05 122.51 14.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.94 -0.573 . . . . 74.31 110.461 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 66.72 60.41 6.19 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.556 -0.83 . . . . 54.52 112.373 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 186' ' ' GLU . . . . . 0.509 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 17.1 tt0 -141.58 148.28 39.03 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.306 -0.257 . . . . 74.34 110.306 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 187' ' ' LYS . . . . . 0.498 ' NZ ' ' HB2' ' A' ' 9' ' ' ALA . 9.9 ttpt -117.26 135.61 53.69 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.184 -0.302 . . . . 74.31 110.184 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.73 168.9 18.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.126 0.489 . . . . 75.44 111.809 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.72 101.11 4.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.597 -0.729 . . . . 75.44 109.711 179.139 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.749 HD12 HD11 ' A' ' 192' ' ' ILE . 0.3 OUTLIER -115.34 143.91 44.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.101 0.477 . . . . 74.01 112.06 -178.853 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.687 ' HB3' HG23 ' A' ' 215' ' ' THR . 8.3 pt-20 -118.0 115.07 24.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.603 -0.726 . . . . 74.25 110.531 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.749 HD11 HD12 ' A' ' 190' ' ' LEU . 3.3 mp -96.93 134.79 33.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 74.04 111.247 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -70.89 166.1 40.66 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.912 -0.586 . . . . 73.33 110.808 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.94 -14.42 44.44 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.579 2.186 . . . . 64.32 112.604 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -79.64 -25.71 41.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.68 0.276 . . . . 70.34 111.245 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 196' ' ' TRP . . . . . . . . . . . . . 12.8 m0 -117.1 37.08 3.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.452 -0.34 . . . . 72.01 111.277 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -145.97 -83.46 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.353 -0.385 . . . . 70.24 111.356 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 198' ' ' TYR . . . . . 0.639 ' CE2' HD13 ' A' ' 208' ' ' ILE . 15.8 m-85 -109.43 -34.5 6.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.901 0.381 . . . . 62.33 110.875 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 118.18 170.02 14.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.85 -0.69 . . . . 72.1 112.577 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.89 -29.0 62.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.806 0.336 . . . . 64.12 110.926 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -66.67 -50.69 62.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.224 -0.444 . . . . 73.25 110.856 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 115.31 -162.66 12.4 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.87 -0.681 . . . . 54.11 112.468 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.547 ' HB3' HD12 ' A' ' 208' ' ' ILE . 1.2 tm0? -137.0 77.65 42.78 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.891 0.377 . . . . 52.43 110.863 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.61 -23.23 24.91 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.625 2.216 . . . . 55.42 112.422 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.96 -41.89 79.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.298 -0.41 . . . . 74.01 111.046 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.96 30.4 6.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.088 -0.506 . . . . 73.11 111.126 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.32 35.67 25.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 73.02 110.918 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.639 HD13 ' CE2' ' A' ' 198' ' ' TYR . 32.0 mt -98.53 111.74 60.78 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.454 . . . . 75.34 111.095 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.13 171.11 15.48 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.478 2.119 . . . . 54.41 112.373 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.56 142.12 69.93 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.586 2.19 . . . . 73.21 112.265 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 54.18 69.44 0.72 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.208 -0.451 . . . . 64.22 111.024 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 212' ' ' ALA . . . . . 0.516 ' HB1' HD22 ' A' ' 139' ' ' LEU . . . -122.43 115.02 21.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 63.32 111.466 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -65.35 131.49 46.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.043 -0.526 . . . . 75.53 110.452 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.512 HD11 ' CE2' ' A' ' 198' ' ' TYR . 4.9 mt -113.58 109.41 18.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.896 0.379 . . . . 64.34 111.68 -179.396 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.687 HG23 ' HB3' ' A' ' 191' ' ' GLU . 2.8 m -109.59 140.1 43.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.546 . . . . 73.13 110.417 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.611 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 4.7 p90 -156.32 -179.29 8.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.013 0.435 . . . . 72.54 111.387 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -134.34 137.65 44.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.721 -0.672 . . . . 74.44 110.432 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.573 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.7 t -120.32 151.76 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.99 0.424 . . . . 63.32 111.997 -179.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -136.33 105.87 6.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.777 -0.647 . . . . 72.1 110.221 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.552 HD21 ' CG1' ' A' ' 223' ' ' ILE . 1.0 OUTLIER -69.96 129.5 39.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.343 -0.39 . . . . 70.33 110.845 -179.755 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 33.7 t -108.24 -28.99 2.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.266 -0.424 . . . . 65.3 111.426 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -171.18 162.23 6.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.839 0.352 . . . . 60.14 111.024 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.644 HG23 HG12 ' A' ' 131' ' ' VAL . 46.5 mt -140.75 111.16 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 61.22 111.135 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 224' ' ' ASP . . . . . 0.589 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 64.31 110.817 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.892 HG11 HG21 ' A' ' 136' ' ' THR . 49.1 t . . . . . 0 CA--C 1.529 0.148 0 CA-C-O 120.611 0.243 . . . . 52.13 110.952 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.426 ' HD2' ' CE1' ' A' ' 72' ' ' PHE . 85.6 Cg_endo -80.46 145.46 16.67 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.632 2.221 . . . . 70.3 112.426 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -81.28 149.72 28.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.267 -0.424 . . . . 74.23 110.884 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.63 98.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 70.42 111.33 -179.66 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.429 ' HB2' ' HE3' ' A' ' 187' ' ' LYS . . . -68.58 -19.19 64.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.983 -0.553 . . . . 63.44 111.391 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.599 ' CD1' HD11 ' A' ' 20' ' ' LEU . 2.9 m-90 -136.99 173.89 11.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.96 0.409 . . . . 74.13 110.914 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.45 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.1 OUTLIER -115.64 150.89 35.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.871 -0.604 . . . . 70.25 110.475 179.673 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.541 HG12 ' HD2' ' A' ' 16' ' ' ARG . 32.7 t -56.11 -32.01 32.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.929 0.395 . . . . 72.55 110.818 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -73.98 -26.29 60.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.959 -0.564 . . . . 71.41 111.21 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.45 ' HB2' HG23 ' A' ' 11' ' ' THR . 6.2 mm100 -82.26 -57.27 3.45 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.892 0.377 . . . . 73.0 111.095 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.754 ' HB3' HG22 ' A' ' 60' ' ' VAL . 3.5 mt -49.67 -63.46 1.1 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.153 -0.476 . . . . 64.55 111.158 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.541 ' HD2' HG12 ' A' ' 12' ' ' VAL . 19.7 mtt180 -54.34 -24.42 19.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.125 -0.489 . . . . 65.24 111.217 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.08 176.97 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.944 0.402 . . . . 75.02 111.115 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -110.35 16.69 21.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.941 -0.572 . . . . 73.01 111.13 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -108.34 -28.02 9.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.519 -0.31 . . . . 74.54 111.093 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.599 HD11 ' CD1' ' A' ' 10' ' ' TRP . 7.0 tt -85.9 113.11 49.8 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.334 -0.393 . . . . 71.24 110.967 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -56.39 123.96 15.11 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.401 2.067 . . . . 72.13 112.172 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -24.11 65.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 74.44 111.089 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.7 mmtp -53.7 -33.59 55.96 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.281 -0.418 . . . . 65.12 111.332 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -78.76 -51.87 9.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.966 0.413 . . . . 71.41 110.998 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.552 HD11 HD22 ' A' ' 20' ' ' LEU . 31.1 mt -46.82 -33.17 2.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.896 -0.593 . . . . 74.44 111.311 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.668 HG12 HD21 ' A' ' 59' ' ' LEU . 12.1 mt -74.95 -52.94 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.084 0.468 . . . . 74.53 111.015 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.684 ' HG3' HD11 ' A' ' 47' ' ' ILE . 0.1 OUTLIER -57.01 -22.8 41.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.752 -0.658 . . . . 75.04 111.323 -179.895 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -75.08 -49.37 19.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.966 0.413 . . . . 55.12 110.851 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.891 HD23 HD12 ' A' ' 66' ' ' LEU . 4.3 mt -65.5 -26.63 68.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.914 -0.585 . . . . 75.22 110.938 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -81.27 -27.03 35.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.295 -0.411 . . . . 70.15 111.038 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.426 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -97.09 -6.13 35.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.492 -0.322 . . . . 75.25 111.198 179.714 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.426 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 92.2 m-70 -128.4 -3.23 5.52 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.346 . . . . 70.42 111.484 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.65 157.21 15.58 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.711 -0.757 . . . . 74.41 112.289 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.4 p -92.66 149.89 21.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.624 0.25 . . . . 65.44 110.625 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.938 ' HA ' HD12 ' A' ' 38' ' ' LEU . 0.6 OUTLIER -44.15 -49.77 8.9 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.405 -0.361 . . . . 74.12 111.49 -179.796 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.6 p -55.03 -47.42 74.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.008 0.433 . . . . 55.12 110.506 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.492 ' CE2' ' CE1' ' A' ' 65' ' ' HIS . 4.1 t80 -58.13 -44.12 87.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.692 . . . . 72.41 110.703 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.938 HD12 ' HA ' ' A' ' 35' ' ' ASP . 3.1 mt -63.57 -49.19 74.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.256 -0.429 . . . . 71.04 110.895 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.829 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -49.2 -28.19 4.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.115 -0.493 . . . . 64.14 111.349 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -77.43 -33.1 54.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 60.12 111.218 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.684 ' ND1' ' HB2' ' A' ' 62' ' ' ALA . 6.3 m-70 -108.78 10.42 26.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.395 -0.366 . . . . 74.24 111.58 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' A' ' 38' ' ' LEU . 12.8 mttp 60.21 31.86 20.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.779 0.323 . . . . 65.23 110.992 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.618 HD11 ' HB1' ' A' ' 62' ' ' ALA . 64.5 mt -84.56 -21.12 30.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 73.31 111.054 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.829 HD11 ' HB2' ' A' ' 39' ' ' ALA . 61.7 mt -48.75 170.34 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.944 0.402 . . . . 64.03 111.104 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.27 -163.39 34.26 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.784 -0.722 . . . . 62.41 112.78 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.884 ' O ' HG23 ' A' ' 50' ' ' VAL . 1.7 t-20 -102.85 148.77 25.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.88 0.372 . . . . 74.12 111.016 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.684 HD11 ' HG3' ' A' ' 27' ' ' LYS . 3.1 mp -45.27 -43.29 3.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.015 -0.539 . . . . 70.1 111.498 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -56.44 -42.33 77.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.877 -0.601 . . . . 73.33 111.092 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -85.74 -28.17 24.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.084 -0.507 . . . . 74.53 111.336 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 46' ' ' ASN . 14.2 t -77.41 -26.42 15.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 75.21 111.478 -179.658 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.55 -25.24 65.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.383 -0.371 . . . . 53.54 111.311 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.3 pttt -95.22 -30.95 13.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.311 -0.404 . . . . 52.31 111.136 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 m -84.98 -22.21 29.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 73.23 111.381 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -113.0 128.7 56.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.828 0.347 . . . . 62.12 111.283 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -78.9 179.89 7.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 74.04 110.447 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.623 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -60.82 -58.48 8.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.84 0.353 . . . . 70.12 110.537 179.96 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.49 -26.38 67.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.109 -0.496 . . . . 63.05 110.6 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.67 -40.4 94.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.114 0.483 . . . . 64.24 110.261 179.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.668 HD21 HG12 ' A' ' 26' ' ' ILE . 17.4 mt -77.42 -30.04 53.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.659 -0.701 . . . . 65.33 111.036 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.754 HG22 ' HB3' ' A' ' 15' ' ' LEU . 17.8 t -79.11 -43.33 24.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.942 0.401 . . . . 65.12 110.752 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 75.4 m -60.05 -34.49 73.49 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.895 -0.593 . . . . 73.44 110.486 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.684 ' HB2' ' ND1' ' A' ' 41' ' ' HIS . . . -82.01 -21.72 36.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.006 -0.543 . . . . 52.42 110.898 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.769 ' HA ' HD21 ' A' ' 29' ' ' LEU . 16.3 t80 -83.79 -22.78 31.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 72.31 110.97 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -85.07 -54.33 4.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.136 -0.483 . . . . 62.21 111.479 -179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.492 ' CE1' ' CE2' ' A' ' 37' ' ' PHE . 2.9 p-80 -62.08 -25.34 67.64 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.16 -0.473 . . . . 74.34 111.385 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.891 HD12 HD23 ' A' ' 29' ' ' LEU . 3.4 tt -53.65 -39.89 65.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.967 0.413 . . . . 74.04 110.945 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.401 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.2 m-85 -79.06 -39.88 32.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.93 -0.577 . . . . 64.42 110.641 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.1 -40.31 90.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.985 -0.552 . . . . 71.1 110.957 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 57.9 p -88.06 -9.77 52.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.033 -0.53 . . . . 74.45 111.413 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.21 33.63 12.87 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.763 0.316 . . . . 72.14 111.192 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 66.6 mtt-85 -92.52 46.18 1.23 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.356 -0.384 . . . . 65.34 111.019 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.562 ' CE1' HD22 ' A' ' 66' ' ' LEU . 91.9 m-85 -67.17 175.8 2.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 65.43 110.856 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 49.4 tttt . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.352 -0.385 . . . . 74.12 110.882 179.949 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.442 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.779 0.323 . . . . 60.11 110.959 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 30.8 p90 -149.46 162.23 40.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 75.02 110.819 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 5.8 m -132.0 103.55 6.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 75.43 111.058 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.408 ' CB ' ' HB3' ' A' ' 190' ' ' LEU . 0.8 OUTLIER -111.09 145.16 39.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.207 -0.451 . . . . 65.31 110.797 179.915 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.425 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.5 m -137.97 130.77 29.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 75.11 110.941 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 22.1 t -80.47 106.32 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 50.12 111.14 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.433 HD13 ' HA ' ' A' ' 188' ' ' ALA . 7.4 mp -76.28 -50.01 15.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.224 -0.444 . . . . 75.02 110.768 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.85 111.55 16.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.089 -0.505 . . . . 74.21 110.902 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.95 142.35 46.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 75.11 110.904 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.488 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -114.57 -155.78 11.27 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.741 -0.742 . . . . 23.4 112.615 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -37.21 -52.43 1.05 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.013 0.435 . . . . 72.5 111.415 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 71.22 35.84 1.49 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.789 -0.642 . . . . 73.2 110.178 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 57.2 m -152.98 -43.81 0.1 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.712 -0.676 . . . . 73.23 110.692 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -92.73 95.85 9.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 72.2 110.838 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -107.41 146.12 32.64 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.138 -0.483 . . . . 61.2 110.756 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -56.35 125.34 18.75 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.429 2.086 . . . . 73.32 112.454 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.02 150.37 22.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.981 -0.554 . . . . 63.32 110.909 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -53.93 114.18 1.49 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.42 . . . . 72.34 110.856 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.14 -23.62 33.87 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.58 -0.819 . . . . 53.43 112.356 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.673 ' O ' HG22 ' A' ' 166' ' ' VAL . 0.6 OUTLIER -81.58 135.59 35.56 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.817 0.341 . . . . 73.4 110.628 179.877 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.575 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 12.8 m -73.62 175.78 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.284 0.564 . . . . 44.33 111.795 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.719 HG12 HG23 ' A' ' 223' ' ' ILE . 20.5 m -157.29 146.37 10.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.247 -0.888 . . . . 71.24 110.509 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.627 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -125.43 117.29 23.35 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.983 -0.287 . . . . 72.31 110.624 179.623 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.483 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 30.9 p -153.97 167.07 30.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.951 0.405 . . . . 75.52 111.151 -179.368 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.629 ' HB3' HD11 ' A' ' 149' ' ' ILE . 62.2 m95 -99.67 160.73 14.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.922 -0.581 . . . . 75.44 110.074 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 34.3 p90 -158.63 134.97 9.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.102 0.477 . . . . 73.41 111.747 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.906 HG23 HG23 ' A' ' 147' ' ' THR . 0.2 OUTLIER -126.89 111.67 14.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.72 -0.673 . . . . 63.54 110.188 179.392 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.591 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.66 144.04 17.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.562 -0.828 . . . . 62.14 113.27 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.71 HG23 HG13 ' A' ' 144' ' ' VAL . 0.2 OUTLIER -150.62 142.11 23.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.806 0.336 . . . . 63.35 110.554 179.642 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.68 HD12 ' HB ' ' A' ' 143' ' ' THR . 87.7 mt -77.96 -178.21 5.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.262 -0.426 . . . . 74.5 110.93 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -58.86 -43.33 90.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.296 -0.411 . . . . 72.23 110.895 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -75.82 -4.72 42.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.96 -0.564 . . . . 55.25 111.448 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' GLY . . . . . 0.533 ' C ' HG22 ' A' ' 138' ' ' THR . . . 92.61 23.07 27.05 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.679 -0.772 . . . . 74.11 112.655 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' THR . . . . . 0.68 ' HB ' HD12 ' A' ' 139' ' ' LEU . 1.3 m -88.28 108.31 19.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.811 0.339 . . . . 62.03 110.776 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.71 HG13 HG23 ' A' ' 138' ' ' THR . 3.7 m -71.16 132.64 33.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 60.43 111.275 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -112.19 -31.19 6.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 63.51 110.895 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -143.83 123.03 12.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 73.34 110.98 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.906 HG23 HG23 ' A' ' 136' ' ' THR . 82.9 m -137.45 105.69 5.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 61.13 110.72 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.525 ' C ' HD12 ' A' ' 149' ' ' ILE . 52.6 t30 -86.17 12.6 9.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 74.55 111.702 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.684 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.6 mp . . . . . 0 C--N 1.332 -0.186 0 CA-C-O 120.83 0.348 . . . . 71.24 110.903 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.786 0.326 . . . . 63.4 111.081 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -146.56 148.22 33.12 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 72.14 110.779 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.84 156.68 65.0 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.474 2.116 . . . . 44.02 112.233 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.2 128.02 32.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.083 -0.508 . . . . 61.04 110.746 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.627 ' HB3' ' CD2' ' A' ' 132' ' ' HIS . 0.6 OUTLIER -105.41 126.68 52.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.27 -0.423 . . . . 62.03 111.054 179.817 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.694 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 19.3 p90 -151.0 140.94 21.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 75.31 110.977 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.616 ' CB ' HG21 ' A' ' 168' ' ' VAL . 10.3 mtpt -69.65 131.25 44.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.333 -0.394 . . . . 64.21 110.828 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.673 HG22 ' O ' ' A' ' 129' ' ' ASP . 34.4 m -87.88 149.21 4.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 55.33 111.182 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 67.99 25.09 74.46 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.764 -0.732 . . . . 61.43 112.595 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.616 HG21 ' CB ' ' A' ' 165' ' ' LYS . 15.7 m -134.24 46.17 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.9 0.381 . . . . 75.05 111.121 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.59 35.52 3.0 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.212 -0.518 . . . . 72.43 113.276 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 170' ' ' LYS . . . . . 0.43 ' CG ' HG23 ' A' ' 168' ' ' VAL . 0.0 OUTLIER -82.15 -47.08 12.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.887 0.375 . . . . 72.12 111.056 -179.91 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 171' ' ' VAL . . . . . 0.443 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.8 OUTLIER -118.48 -179.58 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.049 -0.523 . . . . 61.03 110.971 179.829 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.539 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.22 158.39 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.453 -0.34 . . . . 72.31 111.197 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 23.5 ttm180 -66.52 -28.57 68.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.295 -0.411 . . . . 72.1 111.301 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.48 -36.53 43.72 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.659 -0.781 . . . . 63.21 112.16 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.745 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.3 t90 -78.99 -34.37 44.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.916 0.388 . . . . 64.33 111.096 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -62.46 -38.01 88.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 64.14 110.423 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 177' ' ' GLU . . . . . 0.551 ' O ' HG23 ' A' ' 181' ' ' THR . 2.9 mm-40 -75.45 -29.82 59.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.986 -0.552 . . . . 53.54 110.644 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.634 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -78.76 -58.32 3.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.153 -0.476 . . . . 70.35 111.128 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.694 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 5.8 mt -56.73 -34.38 67.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.983 -0.553 . . . . 51.34 110.898 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 16.4 tp -59.91 -30.34 68.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.248 -0.433 . . . . 64.25 110.694 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 181' ' ' THR . . . . . 0.551 HG23 ' O ' ' A' ' 177' ' ' GLU . 32.5 p -87.11 -3.58 59.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 63.33 111.291 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 71.4 mmm -78.17 154.3 31.27 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.794 0.33 . . . . 70.23 110.718 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 10.4 p -121.19 170.33 9.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 54.42 111.175 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 184' ' ' LYS . . . . . 0.676 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -61.94 117.43 5.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.011 -0.541 . . . . 72.24 110.776 179.876 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 185' ' ' GLY . . . . . 0.407 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 70.48 66.82 2.08 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.701 -0.762 . . . . 31.44 112.224 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 186' ' ' GLU . . . . . 0.488 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 19.0 tt0 -146.02 147.25 31.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.636 0.255 . . . . 74.44 110.563 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 187' ' ' LYS . . . . . 0.429 ' HE3' ' HB2' ' A' ' 9' ' ' ALA . 2.8 ttpm? -121.98 136.54 54.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.761 0.315 . . . . 72.12 110.262 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 188' ' ' ALA . . . . . 0.433 ' HA ' HD13 ' A' ' 116' ' ' LEU . . . -150.0 176.16 11.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.076 0.465 . . . . 74.43 111.495 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.76 135.17 36.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.795 -0.639 . . . . 64.33 109.594 178.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.634 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.2 pt? -140.12 140.02 35.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.2 0.524 . . . . 73.4 112.361 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.682 ' HB3' HG23 ' A' ' 215' ' ' THR . 0.0 OUTLIER -116.3 112.05 20.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.54 -0.754 . . . . 61.44 109.912 178.954 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.53 HD11 ' CZ ' ' A' ' 216' ' ' PHE . 2.1 mp -97.47 143.08 13.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.001 0.429 . . . . 70.2 111.543 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -76.89 154.88 83.11 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.861 -0.609 . . . . 62.34 110.676 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 194' ' ' PRO . . . . . 0.452 ' CG ' ' HA ' ' A' ' 211' ' ' ASN . 73.4 Cg_exo -50.89 -39.84 58.36 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.629 2.219 . . . . 74.31 112.419 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.31 -40.63 82.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 73.42 111.235 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.442 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 5.7 m0 -96.64 36.84 1.33 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.396 -0.365 . . . . 73.51 111.147 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -162.83 -76.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 75.52 110.888 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 198' ' ' TYR . . . . . 0.656 ' CD2' HD11 ' A' ' 214' ' ' LEU . 25.7 m-85 -106.27 -71.21 0.76 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 73.32 110.672 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 143.05 -179.9 20.25 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.799 -0.715 . . . . 55.4 112.673 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -59.34 -33.06 70.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.846 0.355 . . . . 53.32 110.903 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -51.73 48.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 64.51 110.783 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 113.51 -138.82 15.23 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.868 -0.682 . . . . 73.43 112.474 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.649 ' CB ' HD12 ' A' ' 208' ' ' ILE . 0.4 OUTLIER -153.99 79.62 5.12 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.862 0.363 . . . . 62.41 110.824 179.99 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.9 -22.93 25.66 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.577 2.185 . . . . 63.55 112.41 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.8 -41.96 87.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.399 -0.364 . . . . 72.51 110.965 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.429 ' HB3' HG13 ' A' ' 208' ' ' ILE . . . -111.35 27.89 9.25 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.173 -0.467 . . . . 64.12 111.19 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 55.48 30.83 15.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.233 -0.44 . . . . 75.24 111.077 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.649 HD12 ' CB ' ' A' ' 203' ' ' GLN . 31.1 mt -82.14 112.66 37.57 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.431 . . . . 74.33 111.074 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -60.04 158.99 27.44 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.474 2.116 . . . . 73.01 112.303 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -55.71 145.44 71.2 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.618 2.212 . . . . 71.51 112.284 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 211' ' ' ASN . . . . . 0.452 ' HA ' ' CG ' ' A' ' 194' ' ' PRO . 3.2 m-80 45.0 40.93 4.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.15 -0.477 . . . . 62.11 111.358 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -83.24 112.27 19.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 73.13 111.796 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.2 mmmm -65.02 140.63 58.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.009 -0.542 . . . . 75.3 110.276 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.656 HD11 ' CD2' ' A' ' 198' ' ' TYR . 5.4 mt -117.89 109.78 16.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.949 0.405 . . . . 74.22 112.026 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.682 HG23 ' HB3' ' A' ' 191' ' ' GLU . 1.9 m -109.16 142.88 39.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.917 -0.583 . . . . 63.11 110.061 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.598 ' CE1' HD21 ' A' ' 190' ' ' LEU . 14.8 p90 -156.57 -179.27 8.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.118 0.485 . . . . 73.54 111.617 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -131.34 135.16 47.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.612 -0.722 . . . . 74.13 110.418 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.745 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.8 t -122.82 150.46 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.457 . . . . 71.52 111.915 -179.019 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.67 110.45 8.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.733 -0.667 . . . . 75.35 110.256 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.726 HD21 HG13 ' A' ' 223' ' ' ILE . 2.0 tt -69.84 128.55 36.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.39 -0.368 . . . . 54.01 111.02 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 24.6 t -108.51 -29.07 2.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.158 -0.474 . . . . 62.45 111.296 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 222' ' ' ASP . . . . . 0.407 ' N ' HD23 ' A' ' 220' ' ' LEU . 5.4 t70 -170.41 161.14 7.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.881 0.372 . . . . 72.13 111.006 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.726 HG13 HD21 ' A' ' 220' ' ' LEU . 41.7 mt -140.19 110.62 3.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.096 -0.502 . . . . 71.12 111.057 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 224' ' ' ASP . . . . . 0.524 ' HB2' HG23 ' A' ' 130' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 74.03 110.859 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 1.041 HG11 HG21 ' A' ' 136' ' ' THR . 50.3 t . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.637 0.256 . . . . 63.45 111.157 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -81.59 138.84 10.97 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.738 2.292 . . . . 71.54 112.325 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.436 HE22 HD11 ' A' ' 149' ' ' ILE . 11.5 mm100 -81.14 148.84 29.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 70.42 111.052 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.565 ' NE ' HD13 ' A' ' 149' ' ' ILE . 0.0 OUTLIER -51.92 120.59 5.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 74.25 111.102 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -94.95 -10.96 29.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.065 -0.516 . . . . 72.34 111.403 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.612 ' CD1' HD11 ' A' ' 20' ' ' LEU . 3.8 m-90 -138.19 173.67 11.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.912 0.386 . . . . 74.1 110.863 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.433 ' O ' HD12 ' A' ' 15' ' ' LEU . 1.3 m -118.22 152.06 36.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.009 -0.541 . . . . 75.02 110.661 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.506 HG12 ' HD2' ' A' ' 16' ' ' ARG . 34.2 t -57.71 -33.34 44.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.369 -0.378 . . . . 74.41 110.685 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -77.37 -24.94 50.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.964 -0.562 . . . . 62.5 111.037 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.03 -57.65 3.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.832 0.348 . . . . 70.25 110.843 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.709 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.4 mt -51.1 -60.71 2.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.221 -0.445 . . . . 72.24 111.001 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.619 ' HG3' HG11 ' A' ' 60' ' ' VAL . 28.1 mtt180 -54.16 -24.14 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 75.24 111.114 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.12 177.86 0.31 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.307 -0.406 . . . . 70.15 111.045 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -110.31 16.72 21.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.935 -0.575 . . . . 72.21 111.167 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -104.39 -27.86 11.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.514 -0.312 . . . . 73.24 111.156 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.834 HD22 HD11 ' A' ' 25' ' ' ILE . 6.5 tt -86.84 132.16 42.97 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.394 -0.366 . . . . 75.31 111.015 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.636 ' N ' HD23 ' A' ' 20' ' ' LEU . 71.1 Cg_endo -74.48 124.97 9.28 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.52 2.147 . . . . 74.44 112.398 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.402 ' HB3' ' NZ ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -56.93 -26.33 59.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 74.42 111.188 -179.976 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 mmtp -54.65 -49.06 71.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.301 -0.409 . . . . 62.52 111.293 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.05 -33.17 74.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.127 -0.488 . . . . 72.13 111.19 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.834 HD11 HD22 ' A' ' 20' ' ' LEU . 30.1 mt -66.9 -36.53 77.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 62.23 111.223 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.692 HG12 HD21 ' A' ' 59' ' ' LEU . 15.8 mt -71.85 -50.16 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.229 -0.442 . . . . 62.02 111.105 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.509 ' HG3' HD11 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -57.35 -22.9 45.53 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.847 -0.615 . . . . 45.21 111.286 -179.856 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -74.46 -50.81 16.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.013 0.435 . . . . 71.44 110.809 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.75 HD21 ' HA ' ' A' ' 63' ' ' TYR . 4.5 mt -64.3 -39.17 93.37 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.87 -0.605 . . . . 73.24 110.957 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -71.18 -20.22 62.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.309 -0.405 . . . . 73.22 110.727 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.444 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 9.4 tp10 -79.58 -52.21 8.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.133 -0.485 . . . . 64.54 111.472 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.444 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 84.4 m-70 -111.18 16.48 21.0 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.876 0.325 . . . . 73.23 111.876 -179.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' A' ' 29' ' ' LEU . . . -123.05 91.08 0.44 Allowed Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.517 -0.849 . . . . 71.05 112.631 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.1 p -33.68 156.08 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.672 0.619 . . . . 55.21 112.672 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.467 ' HA ' HD12 ' A' ' 38' ' ' LEU . 1.8 p-10 -51.45 -55.91 16.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.673 -0.694 . . . . 63.35 111.443 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.2 t -47.83 -48.05 31.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.04 0.447 . . . . 53.34 110.702 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.493 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 15.9 t80 -55.05 -49.0 72.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.678 -0.692 . . . . 75.5 110.727 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.748 HD22 ' HB3' ' A' ' 43' ' ' LEU . 11.6 mt -62.54 -45.54 92.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 64.14 110.937 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.947 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -49.93 -31.89 13.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.295 -0.411 . . . . 62.31 111.309 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -71.35 -33.15 69.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 74.11 111.034 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.534 ' ND1' ' HB2' ' A' ' 62' ' ' ALA . 14.3 m-70 -110.03 13.32 23.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.348 -0.387 . . . . 75.02 111.502 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt 58.86 33.67 23.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.794 0.331 . . . . 65.1 111.004 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.748 ' HB3' HD22 ' A' ' 38' ' ' LEU . 17.8 mt -88.76 -20.1 25.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.28 -0.418 . . . . 73.03 111.107 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.947 HD11 ' HB2' ' A' ' 39' ' ' ALA . 84.1 mt -47.77 170.32 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.894 0.378 . . . . 51.15 111.175 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.45 -154.78 24.45 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.771 -0.728 . . . . 64.41 112.778 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.87 ' O ' HG23 ' A' ' 50' ' ' VAL . 40.5 m-20 -109.92 150.4 28.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.96 0.41 . . . . 72.44 111.078 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.509 HD11 ' HG3' ' A' ' 27' ' ' LYS . 3.2 mp -46.71 -39.6 4.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.972 -0.558 . . . . 75.24 111.434 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -60.21 -42.45 95.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.057 -0.52 . . . . 64.43 111.102 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -85.56 -26.62 26.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.077 -0.51 . . . . 52.43 111.216 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.87 HG23 ' O ' ' A' ' 46' ' ' ASN . 17.5 t -79.58 -25.83 12.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.405 . . . . 73.53 111.448 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.42 -27.74 68.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.388 -0.369 . . . . 52.5 111.127 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.9 ptpp? -95.18 -29.21 14.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 65.15 110.986 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -96.34 33.55 1.76 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.449 . . . . 63.12 111.13 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -163.68 125.79 2.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.366 -0.379 . . . . 75.42 111.123 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.22 174.64 11.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 73.44 110.633 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.593 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -57.68 -58.29 8.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.892 0.377 . . . . 73.14 110.521 179.945 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.56 -24.48 67.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.005 -0.543 . . . . 72.33 110.584 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.21 -42.57 99.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.15 -0.477 . . . . 64.22 110.375 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.692 HD21 HG12 ' A' ' 26' ' ' ILE . 15.3 mt -74.85 -29.99 61.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.714 -0.675 . . . . 75.32 111.059 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.709 HG22 ' HB3' ' A' ' 15' ' ' LEU . 12.4 t -80.4 -43.87 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.987 0.422 . . . . 73.11 110.824 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.7 m -58.86 -34.33 71.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.93 -0.577 . . . . 73.41 110.532 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.534 ' HB2' ' ND1' ' A' ' 41' ' ' HIS . . . -83.59 -21.77 32.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.997 -0.547 . . . . 62.21 110.952 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.75 ' HA ' HD21 ' A' ' 29' ' ' LEU . 26.8 t80 -82.29 -22.88 35.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 70.42 111.025 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.568 ' ND2' HG12 ' A' ' 60' ' ' VAL . 48.3 m-80 -85.82 -53.18 5.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 74.2 111.474 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.493 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.2 p-80 -62.76 -27.5 69.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.991 -0.549 . . . . 73.31 111.498 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.711 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.5 tt -50.67 -40.68 54.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.871 0.367 . . . . 62.45 111.091 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -79.05 -40.84 30.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.015 -0.539 . . . . 72.4 110.682 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.82 -38.58 91.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.978 -0.556 . . . . 73.41 111.012 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.9 p -87.35 -11.84 48.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.091 -0.504 . . . . 61.55 111.46 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.724 ' HD3' HG21 ' A' ' 144' ' ' VAL . 25.0 mtmt 55.07 32.26 17.9 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.737 0.303 . . . . 75.13 111.161 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 30.9 mtt-85 -91.53 47.22 1.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.32 -0.4 . . . . 71.05 111.023 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -68.28 171.84 6.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 71.53 110.855 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.5 tttp . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.28 -0.418 . . . . 74.42 110.928 179.942 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.461 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.742 0.306 . . . . 75.0 111.123 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.448 ' CZ ' ' HB2' ' A' ' 177' ' ' GLU . 4.1 p90 -132.73 -176.56 4.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 73.52 110.622 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.48 105.59 1.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.796 0.332 . . . . 75.33 111.06 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.483 ' CG ' HD22 ' A' ' 190' ' ' LEU . 0.0 OUTLIER -101.66 139.92 36.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 75.22 110.808 179.837 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.436 ' O ' ' HB1' ' A' ' 188' ' ' ALA . 0.4 OUTLIER -132.34 122.72 25.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 63.23 110.905 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.608 ' O ' HG13 ' A' ' 115' ' ' VAL . 9.5 p -84.0 106.38 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.472 . . . . 54.04 111.067 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.575 HD22 ' N ' ' A' ' 116' ' ' LEU . 2.8 mm? -87.68 -43.33 12.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 73.02 110.788 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 11.8 ttpp -118.22 107.9 14.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 73.23 110.94 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.08 134.36 55.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.211 -0.45 . . . . 74.14 111.057 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -103.23 -106.03 3.02 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.716 -0.754 . . . . 71.32 112.329 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.79 -42.78 11.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.96 0.41 . . . . 71.03 110.703 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.09 33.9 3.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.952 -0.567 . . . . 74.13 110.836 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 61.2 m -156.32 -45.6 0.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 71.23 110.839 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 -83.22 91.88 7.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 63.03 110.972 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -103.71 141.79 23.24 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 71.03 110.821 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.69 125.55 19.44 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.493 2.128 . . . . 72.22 112.356 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -97.98 158.88 15.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.117 -0.492 . . . . 64.03 110.849 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.91 111.13 1.18 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.275 -0.42 . . . . 71.4 110.809 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 111.33 -36.66 4.09 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.755 -0.736 . . . . 61.14 112.338 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.606 ' O ' HG22 ' A' ' 166' ' ' VAL . 0.5 OUTLIER -71.1 130.93 42.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 63.12 110.677 179.854 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.536 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 5.9 m -73.86 179.71 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.98 0.419 . . . . 70.2 111.429 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.804 HG12 HG23 ' A' ' 223' ' ' ILE . 21.5 m -156.84 147.69 11.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.8 -0.636 . . . . 74.34 110.916 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.427 ' HB3' ' HB2' ' A' ' 161' ' ' PRO . 0.7 OUTLIER -124.94 117.7 24.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.553 -0.294 . . . . 63.1 110.38 179.496 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.5 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.1 p -153.73 166.88 31.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.999 0.428 . . . . 55.43 111.509 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.624 ' O ' HG13 ' A' ' 218' ' ' VAL . 54.9 m95 -100.44 163.73 12.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.796 -0.638 . . . . 73.21 110.159 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.453 ' CD1' ' HB2' ' A' ' 148' ' ' ASN . 27.9 p90 -159.2 135.19 8.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.888 0.375 . . . . 64.23 111.593 -179.658 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' THR . . . . . 1.041 HG21 HG11 ' A' ' 5' ' ' VAL . 3.4 m -122.47 106.39 10.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.088 -0.505 . . . . 63.41 110.941 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.738 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -85.98 135.79 13.67 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.938 -0.649 . . . . 70.12 113.32 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.868 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -147.43 143.19 27.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.802 0.334 . . . . 73.53 110.617 179.599 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 139' ' ' LEU . 32.3 mt -81.95 -177.47 6.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 64.44 110.871 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -56.76 -42.86 80.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.469 . . . . 44.11 110.902 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.61 -9.07 58.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.949 -0.569 . . . . 72.3 111.31 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 93.33 25.86 17.63 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.64 -0.79 . . . . 72.12 112.569 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 30.4 m -87.32 108.59 19.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.808 0.337 . . . . 61.1 110.87 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.724 HG21 ' HD3' ' A' ' 70' ' ' LYS . 21.2 t -63.72 127.46 24.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 51.54 111.089 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.428 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 52.1 p90 -110.13 -31.09 7.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.272 -0.422 . . . . 72.2 110.919 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -167.88 112.19 0.66 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 74.52 110.87 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.65 ' OG1' HG23 ' A' ' 136' ' ' THR . 11.9 t -125.07 126.9 46.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.211 -0.45 . . . . 53.01 110.965 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.453 ' HB2' ' CD1' ' A' ' 135' ' ' TYR . 8.8 t30 -65.58 -21.81 66.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.126 -0.488 . . . . 74.33 111.159 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.565 HD13 ' NE ' ' A' ' 8' ' ' ARG . 21.4 mt . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.393 -0.367 . . . . 61.23 111.417 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.465 ' HB1' ' CH2' ' A' ' 134' ' ' TRP . . . . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.814 0.34 . . . . 52.34 111.052 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 7.4 mtpt -131.13 119.36 17.74 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 72.1 110.881 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 161' ' ' PRO . . . . . 0.427 ' HB2' ' HB3' ' A' ' 132' ' ' HIS . 54.0 Cg_exo -52.44 151.16 18.83 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.418 2.079 . . . . 74.14 112.26 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 2.5 tt -79.12 127.78 32.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 74.24 110.706 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.607 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 1.1 p -109.02 127.42 54.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.919 0.39 . . . . 63.14 111.346 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.772 ' CZ ' HD12 ' A' ' 179' ' ' LEU . 15.6 p90 -153.13 145.27 23.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.965 -0.562 . . . . 75.45 110.713 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.643 ' O ' HG22 ' A' ' 168' ' ' VAL . 15.8 mtmt -71.8 134.34 46.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.959 0.409 . . . . 74.31 111.028 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.606 HG22 ' O ' ' A' ' 129' ' ' ASP . 27.0 m -87.93 149.17 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.94 -0.573 . . . . 74.34 111.345 -179.641 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 62.43 29.24 72.78 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.827 -0.701 . . . . 73.51 112.607 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.643 HG22 ' O ' ' A' ' 165' ' ' LYS . 35.4 m -116.76 -33.01 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.927 0.394 . . . . 63.3 111.578 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 111.99 31.29 2.72 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.69 -0.767 . . . . 61.23 111.443 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -88.59 -29.71 19.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.759 0.314 . . . . 70.41 111.067 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 14.8 m -121.75 179.63 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 75.25 111.245 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.502 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 2.7 pt -59.58 169.45 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.108 -0.496 . . . . 63.22 111.082 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -76.05 -28.41 57.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.315 -0.402 . . . . 72.0 111.099 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -73.15 -30.57 62.76 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.72 -0.752 . . . . 74.55 112.015 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.794 ' HE1' HG21 ' A' ' 218' ' ' VAL . 0.6 OUTLIER -84.05 -34.46 24.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.88 0.372 . . . . 74.12 110.838 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -58.31 -40.76 82.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.036 -0.529 . . . . 73.11 110.488 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 177' ' ' GLU . . . . . 0.448 ' HB2' ' CZ ' ' A' ' 111' ' ' TYR . 4.8 mt-10 -80.14 -29.4 38.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.847 -0.615 . . . . 74.41 110.631 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.483 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -76.07 -60.77 2.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.205 -0.452 . . . . 64.31 111.23 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.772 HD12 ' CZ ' ' A' ' 164' ' ' PHE . 0.3 OUTLIER -56.3 -35.04 67.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.975 -0.557 . . . . 73.32 110.992 -179.95 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.5 tp -64.76 -28.4 69.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 63.43 111.06 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 22.4 m -89.5 -8.81 52.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.3 -0.409 . . . . 63.53 111.444 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -77.6 156.29 30.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.819 0.342 . . . . 75.31 110.963 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.81 168.96 9.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 73.23 110.875 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 184' ' ' LYS . . . . . 0.605 ' HA ' HD11 ' A' ' 223' ' ' ILE . 16.6 tttp -68.36 125.31 26.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.272 -0.422 . . . . 71.54 110.99 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 70.28 35.34 69.71 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.834 -0.698 . . . . 72.24 112.597 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -120.37 147.24 45.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.831 0.348 . . . . 75.22 110.922 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt -114.82 140.49 48.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 72.1 110.117 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 188' ' ' ALA . . . . . 0.436 ' HB1' ' O ' ' A' ' 114' ' ' SER . . . -147.58 175.86 10.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.028 0.442 . . . . 75.04 111.705 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 189' ' ' ARG . . . . . 0.469 ' C ' HD23 ' A' ' 190' ' ' LEU . 0.0 OUTLIER -128.23 120.05 26.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.777 -0.647 . . . . 72.13 109.981 179.568 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.857 ' O ' HG23 ' A' ' 215' ' ' THR . 3.5 mt -99.4 161.66 13.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.429 0.633 . . . . 71.42 112.271 -179.042 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -149.13 105.11 3.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.843 -1.071 . . . . 63.14 109.696 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.547 HG21 ' O ' ' A' ' 196' ' ' TRP . 3.0 mt -111.7 138.12 41.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.065 0.459 . . . . 75.45 111.798 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.423 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.3 mt-10 -75.84 167.83 33.22 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.647 -0.706 . . . . 54.44 110.445 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 194' ' ' PRO . . . . . 0.423 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 36.3 Cg_endo -64.8 -15.56 50.91 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.46 2.107 . . . . 74.33 112.633 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.14 -24.78 30.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.567 -0.288 . . . . 72.34 111.701 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.547 ' O ' HG21 ' A' ' 192' ' ' ILE . 3.0 m0 -110.37 37.18 2.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.74 0.305 . . . . 74.41 111.558 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 197' ' ' ALA . . . . . 0.487 ' HB1' HD12 ' A' ' 214' ' ' LEU . . . -149.78 -83.07 0.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.428 -0.351 . . . . 72.34 111.43 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 198' ' ' TYR . . . . . 0.647 ' CE2' HD13 ' A' ' 208' ' ' ILE . 25.5 m-85 -107.72 -31.65 7.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.98 0.419 . . . . 73.02 110.921 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 119.61 169.18 14.13 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.875 -0.679 . . . . 61.4 112.629 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.01 -29.75 44.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.885 0.374 . . . . 73.22 110.834 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -67.34 -46.88 72.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.081 -0.509 . . . . 73.52 110.68 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.56 -141.81 16.74 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.819 -0.705 . . . . 74.33 112.396 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.647 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.0 OUTLIER -155.77 79.41 4.25 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 120.846 0.355 . . . . 64.42 110.773 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.16 -22.68 26.53 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.65 2.233 . . . . 74.13 112.567 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.01 -42.05 84.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.898 0.38 . . . . 62.22 110.992 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.73 31.2 6.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.116 -0.493 . . . . 70.03 111.11 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 18.1 mtpt 56.86 32.95 22.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.246 -0.434 . . . . 75.55 110.935 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.647 HD12 ' HB3' ' A' ' 203' ' ' GLN . 50.4 mt -93.26 111.8 53.55 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.143 -0.481 . . . . 74.22 111.046 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -69.16 170.67 15.32 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.426 2.084 . . . . 61.02 112.384 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.23 151.47 49.04 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.63 2.22 . . . . 73.4 112.461 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 211' ' ' ASN . . . . . 0.401 ' HA ' ' CG ' ' A' ' 194' ' ' PRO . 24.2 m-80 57.15 24.86 10.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 71.11 111.329 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -83.75 147.22 27.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.894 0.378 . . . . 74.43 111.467 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 213' ' ' LYS . . . . . 0.728 ' O ' HD23 ' A' ' 214' ' ' LEU . 1.0 OUTLIER -93.92 156.09 16.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 72.14 110.303 179.519 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.728 HD23 ' O ' ' A' ' 213' ' ' LYS . 14.1 mt -136.4 109.51 7.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.953 0.406 . . . . 52.13 111.857 -179.581 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.857 HG23 ' O ' ' A' ' 190' ' ' LEU . 94.9 m -111.27 141.19 45.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.933 -0.576 . . . . 74.53 110.251 179.504 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.738 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 21.4 p90 -161.78 120.12 2.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.951 0.405 . . . . 74.52 111.73 -179.647 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.68 139.45 47.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.022 -0.535 . . . . 75.32 110.813 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.794 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.6 t -123.02 151.32 27.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.997 -0.547 . . . . 60.31 111.102 -179.429 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -136.8 111.32 8.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.281 -0.418 . . . . 64.24 110.639 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.735 HD13 HD11 ' A' ' 223' ' ' ILE . 0.4 OUTLIER -69.56 129.54 39.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.842 0.353 . . . . 71.13 110.835 -179.722 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 40.1 t -107.37 -30.54 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.475 . . . . 74.44 111.07 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -167.74 157.8 10.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.211 -0.45 . . . . 62.24 110.895 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.804 HG23 HG12 ' A' ' 131' ' ' VAL . 3.9 mp -141.14 111.31 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 74.11 111.091 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 34.5 t70 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 62.21 110.935 -179.961 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.702 HG23 ' OG1' ' A' ' 138' ' ' THR . 42.4 t . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 120.602 0.239 . . . . 72.22 110.798 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.454 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.3 Cg_endo -78.48 134.67 12.64 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.654 2.236 . . . . 74.21 112.525 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -80.19 156.54 26.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.178 -0.464 . . . . 61.13 110.807 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.25 93.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 60.24 111.379 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.44 86.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 73.33 110.992 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.573 ' CD1' HD11 ' A' ' 20' ' ' LEU . 1.5 m-90 -115.46 173.64 6.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.966 -0.561 . . . . 73.53 110.689 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.482 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -118.2 154.77 31.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.101 -0.5 . . . . 73.51 110.618 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.421 HG13 ' CD ' ' A' ' 16' ' ' ARG . 95.9 t -57.11 -35.87 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.973 0.416 . . . . 64.31 110.501 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -67.96 -30.34 69.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.87 -0.605 . . . . 41.44 111.143 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -82.04 -56.09 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.37 -0.377 . . . . 74.32 111.238 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.755 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.5 mt -49.55 -65.6 0.54 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.285 -0.416 . . . . 75.3 111.327 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.899 ' HD2' HG11 ' A' ' 60' ' ' VAL . 0.1 OUTLIER -53.71 -25.49 18.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 65.21 111.259 -179.898 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.42 173.68 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.99 0.424 . . . . 75.52 111.36 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.38 17.04 21.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.888 -0.596 . . . . 72.41 111.176 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -112.23 -19.98 12.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.655 0.264 . . . . 73.42 111.307 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.573 HD11 ' CD1' ' A' ' 10' ' ' TRP . 2.1 tt -90.59 112.18 51.68 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.609 -0.269 . . . . 74.54 111.008 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -57.69 128.42 29.1 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.411 2.074 . . . . 72.42 112.227 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.834 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -63.4 -24.15 67.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.462 . . . . 74.24 111.204 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.458 ' HA ' HD12 ' A' ' 26' ' ' ILE . 3.6 tptt -51.76 -40.13 59.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.394 -0.366 . . . . 74.5 111.581 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.89 -57.42 4.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.957 0.408 . . . . 70.43 111.164 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.834 HD12 ' HA ' ' A' ' 22' ' ' LYS . 4.7 mt -44.81 -32.78 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.891 -0.595 . . . . 75.44 111.556 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.673 HG12 HD21 ' A' ' 59' ' ' LEU . 7.4 mt -75.1 -40.7 44.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.937 0.399 . . . . 74.11 110.991 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -71.02 -24.03 62.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.977 -0.556 . . . . 63.33 111.029 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 24.1 t80 -71.47 -45.05 63.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.041 0.448 . . . . 53.41 110.86 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.854 HD13 HD13 ' A' ' 43' ' ' LEU . 6.1 mt -69.57 -24.01 63.64 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.783 -0.644 . . . . 74.52 111.11 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -79.3 -25.05 42.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.348 -0.387 . . . . 74.4 111.005 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.1 -10.58 18.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.384 -0.371 . . . . 72.33 111.24 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 11.9 m170 -117.62 -9.7 10.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.54 -0.3 . . . . 75.52 111.438 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.49 164.4 15.53 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.688 -0.768 . . . . 64.21 112.379 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.98 150.4 21.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.683 0.277 . . . . 61.51 110.555 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.681 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.5 OUTLIER -48.55 -57.01 6.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.833 0.349 . . . . 45.54 111.02 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.92 -49.57 39.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.054 0.454 . . . . 51.22 110.625 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.55 ' CE2' HD12 ' A' ' 66' ' ' LEU . 14.8 t80 -54.61 -48.02 72.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.707 -0.678 . . . . 63.24 110.431 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.419 HD21 ' O ' ' A' ' 29' ' ' LEU . 14.6 mt -63.98 -42.02 97.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.933 -0.576 . . . . 75.32 110.837 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.824 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -46.68 -40.29 12.96 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.187 -0.46 . . . . 71.12 111.05 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.56 -50.13 33.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.806 -0.634 . . . . 73.24 111.09 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -102.46 14.04 32.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.088 -0.505 . . . . 74.25 111.293 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.2 mttt 57.47 42.0 25.21 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.842 0.353 . . . . 74.55 110.959 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.854 HD13 HD13 ' A' ' 29' ' ' LEU . 19.8 mt -92.25 -22.43 19.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 71.14 111.463 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.824 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -77.6 156.8 30.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.026 0.441 . . . . 72.14 111.23 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.31 -122.27 5.39 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.646 -0.707 . . . . 73.33 112.489 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.846 ' O ' HG23 ' A' ' 50' ' ' VAL . 4.8 m120 -116.3 117.76 30.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.814 0.34 . . . . 74.44 110.964 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.665 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.97 -54.96 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.186 -0.461 . . . . 73.24 111.414 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.2 -37.81 16.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.9 -0.591 . . . . 45.33 111.075 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -85.77 -25.58 26.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.009 -0.541 . . . . 70.33 111.13 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.846 HG23 ' O ' ' A' ' 46' ' ' ASN . 25.1 t -82.35 -25.82 8.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 75.41 111.423 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.21 -15.78 63.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.815 0.341 . . . . 71.14 111.189 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.12 -32.36 13.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 75.55 110.914 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.0 m -88.82 -33.6 17.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.326 -0.397 . . . . 73.53 111.053 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -91.96 125.34 36.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 71.03 111.191 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -82.09 175.83 10.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 73.11 110.602 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.532 ' O ' HG23 ' A' ' 60' ' ' VAL . 6.9 tptt -58.42 -58.18 9.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.857 0.36 . . . . 73.54 110.587 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.0 -26.67 68.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.083 -0.508 . . . . 65.4 110.503 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -42.85 99.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.128 -0.487 . . . . 72.21 110.376 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.673 HD21 HG12 ' A' ' 26' ' ' ILE . 19.3 mt -71.6 -32.75 68.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.69 -0.686 . . . . 74.31 110.928 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.899 HG11 ' HD2' ' A' ' 16' ' ' ARG . 13.0 t -78.43 -42.29 26.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 52.24 110.94 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.3 m -59.41 -36.94 76.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.964 -0.562 . . . . 74.35 110.64 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.465 ' HB3' HD11 ' A' ' 43' ' ' LEU . . . -80.75 -22.17 40.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.019 -0.537 . . . . 75.11 110.999 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.647 ' HA ' HD21 ' A' ' 29' ' ' LEU . 21.6 t80 -83.78 -22.85 31.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 71.42 111.026 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -83.09 -54.73 4.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.279 -0.419 . . . . 74.35 111.545 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.501 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 4.2 p-80 -61.7 -29.13 69.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.098 -0.501 . . . . 71.0 111.366 -179.43 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.603 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.0 tt -51.98 -39.27 59.09 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.901 0.381 . . . . 74.24 111.118 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -78.81 -36.53 42.54 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.068 -0.514 . . . . 70.52 110.608 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.97 -39.87 83.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.961 -0.563 . . . . 61.53 110.745 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.68 -3.52 52.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.978 -0.556 . . . . 72.02 111.359 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.641 ' HE2' HG21 ' A' ' 136' ' ' THR . 8.3 mmtp 48.5 38.97 11.99 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.752 0.31 . . . . 75.41 111.316 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -93.85 43.5 1.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.379 . . . . 64.05 111.111 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.552 ' HA ' HD21 ' A' ' 66' ' ' LEU . 86.4 m-85 -66.3 179.61 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.434 . . . . 74.34 110.889 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.9 tttt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 72.41 110.893 179.908 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.87 0.366 . . . . 74.43 110.819 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -165.66 163.95 19.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 70.12 110.807 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' THR . . . . . 0.413 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 33.3 m -128.33 129.0 45.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.469 . . . . 75.4 110.668 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.708 ' HD2' ' HB1' ' A' ' 178' ' ' ALA . 8.0 tttm -128.88 151.47 49.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.31 -0.405 . . . . 61.53 110.972 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.407 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.4 m -150.27 123.14 8.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 60.24 110.872 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 29.8 t -80.37 106.33 11.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 73.24 111.454 -179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.407 HD12 ' O ' ' A' ' 114' ' ' SER . 7.5 mp -76.46 -59.99 2.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.143 -0.48 . . . . 63.34 110.497 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -112.94 108.05 16.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.93 -0.577 . . . . 62.01 110.681 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.8 mtmp? -60.97 142.86 56.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 70.43 110.969 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.404 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -110.44 -159.04 16.72 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.773 -0.727 . . . . 65.32 112.211 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -35.03 -46.71 0.33 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.814 0.34 . . . . 63.1 111.654 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.626 ' O ' HG23 ' A' ' 122' ' ' THR . 0.5 OUTLIER 72.6 39.21 0.72 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 73.41 110.3 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.626 HG23 ' O ' ' A' ' 121' ' ' LYS . 0.8 OUTLIER -167.71 -42.68 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.686 -0.688 . . . . 71.41 110.423 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -84.71 86.4 7.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.018 -0.537 . . . . 75.13 110.669 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -106.0 155.54 38.23 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.044 -0.525 . . . . 64.34 110.822 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.6 ' HB2' HG21 ' A' ' 166' ' ' VAL . 56.0 Cg_endo -70.25 125.53 11.99 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.537 2.158 . . . . 50.54 112.469 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.25 155.66 17.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.095 -0.502 . . . . 74.25 110.867 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 1.1 tptm -56.92 119.23 5.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 75.51 110.945 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 94.44 -9.41 71.73 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.721 -0.752 . . . . 74.01 112.758 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.27 140.15 29.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.871 0.367 . . . . 62.53 110.995 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.69 HG12 ' O ' ' A' ' 224' ' ' ASP . 7.3 p -70.86 162.44 4.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.107 -0.497 . . . . 70.03 111.014 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.743 HG22 ' O ' ' A' ' 164' ' ' PHE . 4.4 m -153.59 144.98 14.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.137 -0.483 . . . . 64.54 111.009 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.451 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.87 117.84 22.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.738 0.304 . . . . 73.41 110.763 179.528 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.735 ' HB3' HD22 ' A' ' 220' ' ' LEU . 30.3 p -150.21 168.94 22.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.077 0.465 . . . . 54.44 111.102 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.838 ' HB3' HD11 ' A' ' 149' ' ' ILE . 80.6 m95 -102.64 157.52 16.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.729 -0.669 . . . . 64.14 110.015 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 53.2 p90 -162.23 138.73 7.86 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.148 0.499 . . . . 72.43 112.055 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.679 HG21 HG11 ' A' ' 5' ' ' VAL . 22.1 m -131.35 116.23 17.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.478 -0.783 . . . . 73.24 110.335 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.599 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -98.16 145.17 17.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.601 -0.809 . . . . 63.12 113.291 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.702 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.1 OUTLIER -147.9 143.24 27.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.832 0.349 . . . . 62.34 110.75 179.756 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.778 HD11 HG12 ' A' ' 208' ' ' ILE . 90.7 mt -88.64 -179.53 6.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 73.33 110.756 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -52.88 -45.14 67.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.301 -0.409 . . . . 74.01 111.075 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.0 -13.22 62.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.974 -0.557 . . . . 74.01 111.326 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 88.27 25.85 29.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.651 -0.785 . . . . 64.45 112.59 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -98.27 124.88 43.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.815 0.341 . . . . 74.21 110.817 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.2 t -63.7 129.41 27.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 62.23 111.085 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.43 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 54.1 p90 -110.83 -33.65 6.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 73.24 111.012 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' ASP . . . . . 0.41 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 13.9 m-20 -162.53 110.27 1.32 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 75.42 110.949 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 9.2 t -142.91 127.68 18.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 71.44 110.951 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 34.2 p-10 -92.71 52.58 1.89 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 73.23 110.385 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.838 HD11 ' HB3' ' A' ' 134' ' ' TRP . 27.9 mm . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.064 -0.516 . . . . 65.53 110.886 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.817 0.341 . . . . 73.12 111.08 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.25 146.45 36.47 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 65.03 110.819 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.42 155.84 68.66 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.538 2.159 . . . . 72.33 112.234 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.417 ' O ' HD23 ' A' ' 162' ' ' LEU . 3.6 tt -75.44 121.44 22.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.31 -0.404 . . . . 73.32 110.576 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.621 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.67 122.29 42.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.946 0.403 . . . . 73.13 111.305 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.743 ' O ' HG22 ' A' ' 131' ' ' VAL . 10.8 p90 -151.81 143.67 23.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.909 -0.587 . . . . 72.34 110.557 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.581 ' O ' HG22 ' A' ' 168' ' ' VAL . 4.6 mttp -80.96 138.71 36.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.079 0.466 . . . . 73.24 111.323 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.6 HG21 ' HB2' ' A' ' 125' ' ' PRO . 35.8 m -87.38 149.42 4.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.618 -0.719 . . . . 71.52 111.188 -179.388 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.77 21.71 78.86 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.805 -0.712 . . . . 53.23 112.637 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.745 HG23 ' HG2' ' A' ' 170' ' ' LYS . 29.3 m -130.16 41.15 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.871 0.367 . . . . 74.13 111.134 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.47 38.58 5.34 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 121.125 -0.56 . . . . 74.23 113.154 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 170' ' ' LYS . . . . . 0.745 ' HG2' HG23 ' A' ' 168' ' ' VAL . 0.4 OUTLIER -84.69 -41.86 15.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.865 0.364 . . . . 72.35 110.95 -179.945 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.7 m -121.95 179.78 2.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.112 -0.494 . . . . 54.24 110.994 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.539 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -59.88 159.48 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.331 -0.395 . . . . 75.44 111.158 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -67.72 -28.26 67.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.204 -0.453 . . . . 72.03 111.139 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.5 -37.58 46.43 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.668 -0.777 . . . . 61.32 111.958 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.714 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.3 t90 -78.33 -33.48 49.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.919 0.39 . . . . 62.43 110.998 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 176' ' ' ASP . . . . . 0.697 ' O ' HD13 ' A' ' 180' ' ' LEU . 38.9 t70 -64.31 -33.87 76.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.967 -0.561 . . . . 75.33 110.444 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -78.65 -29.71 45.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 71.4 110.662 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.708 ' HB1' ' HD2' ' A' ' 113' ' ' LYS . . . -81.16 -45.47 16.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 50.21 111.105 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.62 HD21 ' NE1' ' A' ' 175' ' ' TRP . 11.8 mt -72.39 -18.92 61.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.016 -0.538 . . . . 74.25 111.167 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.697 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.3 tp -56.38 -24.18 42.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.429 -0.351 . . . . 72.54 111.345 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 16.2 p -114.5 18.09 16.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.627 -0.26 . . . . 75.3 111.618 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 3.5 mmm -68.13 103.48 1.56 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.869 0.366 . . . . 73.02 110.913 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.22 148.99 49.06 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.195 -0.457 . . . . 75.13 110.839 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 3.2 ttmt -54.85 115.77 2.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.506 . . . . 70.31 111.216 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 77.39 20.05 75.48 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.921 -0.656 . . . . 60.02 113.201 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 186' ' ' GLU . . . . . 0.404 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.6 tt0 -93.69 146.48 23.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.867 0.333 . . . . 73.3 111.032 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -119.22 136.23 54.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 73.24 109.936 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -150.57 176.25 11.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.106 0.479 . . . . 63.34 111.831 -179.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.88 133.52 33.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.604 -0.726 . . . . 73.22 109.477 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.701 HD11 ' CD1' ' A' ' 175' ' ' TRP . 1.6 pt? -140.07 141.53 36.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.135 0.493 . . . . 74.45 112.109 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.828 ' HG3' HG23 ' A' ' 215' ' ' THR . 2.5 mp0 -116.94 112.39 20.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.549 -0.75 . . . . 64.22 110.021 179.185 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.58 HD11 HD12 ' A' ' 190' ' ' LEU . 1.3 mm -92.18 150.26 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.922 0.391 . . . . 73.35 111.214 -179.515 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -83.37 166.4 35.04 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.525 . . . . 72.53 110.69 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 194' ' ' PRO . . . . . 0.402 ' CB ' ' HA ' ' A' ' 211' ' ' ASN . 40.1 Cg_endo -66.91 -14.76 44.95 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.532 2.155 . . . . 73.1 112.6 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -84.23 -31.18 25.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 62.13 111.034 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.435 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 14.4 m0 -107.54 37.03 2.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.416 . . . . 74.02 111.075 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -154.44 -81.06 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 64.41 111.087 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 198' ' ' TYR . . . . . 0.582 ' CE2' HD11 ' A' ' 214' ' ' LEU . 41.7 m-85 -106.11 -71.31 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.033 0.444 . . . . 74.13 110.762 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 151.34 176.56 24.28 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.721 -0.752 . . . . 43.32 112.597 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.31 -30.01 36.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.857 0.36 . . . . 74.42 110.798 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -49.73 19.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 70.31 110.686 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 107.35 -128.22 9.13 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.836 -0.697 . . . . 53.02 112.536 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.732 ' CB ' HD12 ' A' ' 208' ' ' ILE . 0.0 OUTLIER -156.69 82.34 3.34 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.871 0.367 . . . . 71.43 110.753 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.57 -24.57 29.51 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.634 2.223 . . . . 71.3 112.481 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.42 -42.02 96.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.845 0.355 . . . . 75.41 111.027 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -103.53 28.83 6.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 70.25 111.257 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.43 29.8 15.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.268 -0.424 . . . . 73.43 111.023 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.778 HG12 HD11 ' A' ' 139' ' ' LEU . 40.2 mt -90.49 111.68 48.77 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.219 -0.446 . . . . 71.23 111.07 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.21 170.89 19.14 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.527 2.151 . . . . 73.11 112.429 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.7 142.15 96.99 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.641 2.228 . . . . 71.13 112.177 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 211' ' ' ASN . . . . . 0.402 ' HA ' ' CB ' ' A' ' 194' ' ' PRO . 57.5 m-80 47.82 76.67 0.11 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.356 -0.384 . . . . 70.2 111.116 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.08 113.56 17.91 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.357 -0.383 . . . . 70.12 111.581 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.57 126.84 29.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.134 -0.485 . . . . 41.33 110.253 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.582 HD11 ' CE2' ' A' ' 198' ' ' TYR . 13.0 mt -103.35 109.45 21.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.851 0.358 . . . . 72.13 111.556 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.828 HG23 ' HG3' ' A' ' 191' ' ' GLU . 20.5 m -103.26 136.85 42.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 62.4 110.617 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.627 ' CE1' HD21 ' A' ' 190' ' ' LEU . 29.3 p90 -155.38 176.3 12.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.061 0.458 . . . . 64.35 111.539 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -131.63 135.29 46.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.707 -0.679 . . . . 75.43 110.612 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.714 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.3 t -121.95 149.99 25.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.11 0.481 . . . . 73.41 111.924 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -136.91 110.46 8.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.737 -0.665 . . . . 72.4 110.453 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.735 HD22 ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.93 130.76 43.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.345 . . . . 70.22 110.897 -179.664 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.415 HG23 ' HA ' ' A' ' 133' ' ' CYS . 18.3 t -110.25 -30.13 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.221 -0.445 . . . . 52.25 111.633 -179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -168.86 158.61 8.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.865 0.364 . . . . 62.42 111.069 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.668 HG23 HG12 ' A' ' 131' ' ' VAL . 3.4 mp -142.12 112.12 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 63.32 111.097 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 224' ' ' ASP . . . . . 0.69 ' O ' HG12 ' A' ' 130' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-O 121.073 0.463 . . . . 73.15 110.826 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 1.043 HG11 HG21 ' A' ' 136' ' ' THR . 33.2 t . . . . . 0 CA--C 1.528 0.128 0 CA-C-O 120.595 0.236 . . . . 64.44 111.044 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.423 ' HD2' ' CD2' ' A' ' 72' ' ' PHE . 92.4 Cg_endo -78.98 139.56 15.36 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.607 2.205 . . . . 71.4 112.428 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -80.62 151.87 28.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.168 -0.469 . . . . 51.22 110.827 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.82 92.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.2 -0.455 . . . . 73.54 111.299 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.89 -35.45 76.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 71.05 111.027 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 2.4 m-90 -114.62 173.68 6.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.087 -0.506 . . . . 72.33 110.866 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.449 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -118.25 154.33 32.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.081 -0.509 . . . . 72.32 110.644 179.774 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.51 HG12 ' HD2' ' A' ' 16' ' ' ARG . 43.7 t -55.13 -34.28 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.353 -0.385 . . . . 51.24 110.927 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -65.01 -32.38 74.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.108 -0.496 . . . . 72.51 110.839 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.449 ' HB2' HG23 ' A' ' 11' ' ' THR . 1.4 tp-100 -82.05 -56.1 4.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.346 -0.388 . . . . 73.24 110.835 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.82 ' HB3' HG22 ' A' ' 60' ' ' VAL . 8.3 mt -50.21 -28.75 8.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.202 -0.454 . . . . 64.32 110.82 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.51 ' HD2' HG12 ' A' ' 12' ' ' VAL . 60.6 mtt180 -94.63 -28.7 15.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.766 -0.652 . . . . 72.43 110.337 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.4 t -53.12 170.2 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.881 -0.6 . . . . 64.11 111.314 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -103.69 17.11 24.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.733 -0.667 . . . . 73.33 111.123 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -113.65 -20.66 11.12 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.489 -0.323 . . . . 72.2 111.357 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.649 HD23 ' N ' ' A' ' 21' ' ' PRO . 6.2 tt -84.78 129.48 56.61 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.591 -0.277 . . . . 73.43 110.959 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.649 ' N ' HD23 ' A' ' 20' ' ' LEU . 73.6 Cg_endo -77.23 125.64 7.97 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.5 2.133 . . . . 55.51 112.255 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -24.1 66.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 70.34 110.952 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.428 ' HA ' HD12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -54.26 -35.21 62.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.282 -0.417 . . . . 62.44 111.465 -179.751 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.26 -54.48 6.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.966 0.413 . . . . 64.25 111.046 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.673 ' O ' HD12 ' A' ' 29' ' ' LEU . 29.1 mt -45.0 -32.9 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 64.04 111.38 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.641 HG12 HD21 ' A' ' 59' ' ' LEU . 6.1 mt -76.51 -49.97 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 54.04 110.925 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.42 ' HE2' HD13 ' A' ' 47' ' ' ILE . 34.8 mttm -64.8 -25.57 67.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.812 -0.631 . . . . 72.44 111.115 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -70.4 -45.38 66.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.997 0.427 . . . . 75.24 110.834 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.764 HD21 ' HA ' ' A' ' 63' ' ' TYR . 3.4 mt -69.97 -36.48 75.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.851 -0.613 . . . . 65.53 110.946 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.495 ' HA ' HD11 ' A' ' 38' ' ' LEU . 6.7 mt-30 -69.59 -20.72 63.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.176 -0.465 . . . . 72.45 110.707 179.546 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.2 -51.06 5.35 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.148 -0.478 . . . . 72.34 110.963 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -88.87 0.91 56.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 71.52 111.612 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.38 160.45 14.33 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.673 -0.775 . . . . 64.24 112.445 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -92.55 151.87 19.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.547 0.213 . . . . 71.24 110.458 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.685 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -48.94 -57.12 6.98 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.81 0.338 . . . . 54.44 111.176 -179.745 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -47.78 -51.65 21.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.059 0.457 . . . . 61.22 110.842 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.508 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 10.8 t80 -52.76 -47.51 67.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.82 -0.627 . . . . 62.51 110.477 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.495 HD11 ' HA ' ' A' ' 30' ' ' GLN . 11.2 mt -66.32 -40.88 90.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.073 -0.512 . . . . 64.45 110.764 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.804 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.83 -47.51 31.3 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.056 0.455 . . . . 71.13 111.079 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -57.64 -26.91 62.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.765 -0.652 . . . . 74.03 110.895 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 43.9 m-70 -112.63 11.16 19.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.276 -0.42 . . . . 75.12 111.261 179.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt 51.15 35.47 13.3 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.858 0.361 . . . . 64.13 110.93 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.652 HD13 HD13 ' A' ' 29' ' ' LEU . 29.1 mt -94.18 -20.34 19.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.132 -0.485 . . . . 73.45 111.736 -179.405 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.804 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.69 158.76 26.89 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.046 0.45 . . . . 63.32 111.121 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 114.57 -119.37 4.67 Favored Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 115.798 -0.637 . . . . 75.24 112.404 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.747 ' O ' HG23 ' A' ' 50' ' ' VAL . 5.6 m120 -116.34 113.79 23.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.751 0.31 . . . . 70.13 110.9 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.617 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -45.58 -54.64 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.192 -0.458 . . . . 74.42 111.374 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.27 -36.55 9.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.87 -0.605 . . . . 71.42 110.92 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -85.64 -25.23 26.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.992 -0.549 . . . . 74.21 111.102 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.747 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.7 t -83.45 -25.81 7.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.297 -0.41 . . . . 70.34 111.479 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.0 -15.83 63.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.37 -0.377 . . . . 65.11 111.41 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -95.19 -34.02 12.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.818 0.342 . . . . 73.3 110.999 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.623 HG22 ' HA ' ' A' ' 50' ' ' VAL . 9.8 t -87.94 -30.56 19.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.46 . . . . 65.51 111.081 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.45 125.8 37.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.427 . . . . 73.32 111.132 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.09 174.84 10.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 71.25 110.642 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.627 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -57.77 -58.1 9.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.861 0.363 . . . . 62.43 110.505 179.932 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.59 -26.99 68.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.121 -0.491 . . . . 75.34 110.573 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.91 -43.4 98.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.095 -0.502 . . . . 70.44 110.475 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.641 HD21 HG12 ' A' ' 26' ' ' ILE . 20.4 mt -73.48 -32.64 64.41 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.713 -0.676 . . . . 73.41 110.973 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.82 HG22 ' HB3' ' A' ' 15' ' ' LEU . 15.9 t -76.9 -42.39 32.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.005 0.431 . . . . 74.11 110.695 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.0 m -60.73 -33.44 72.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.869 -0.605 . . . . 73.34 110.516 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.445 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -81.13 -22.25 39.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.483 . . . . 75.32 111.045 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.764 ' HA ' HD21 ' A' ' 29' ' ' LEU . 14.0 t80 -83.66 -22.9 32.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.099 -0.5 . . . . 73.11 111.126 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -83.95 -54.16 5.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.046 0.45 . . . . 71.22 111.294 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.585 ' HD2' HG21 ' A' ' 69' ' ' THR . 3.1 p-80 -60.78 -31.09 70.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.02 -0.536 . . . . 65.11 111.036 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.648 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.7 tt -46.1 -41.12 11.89 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.899 0.381 . . . . 63.2 111.162 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -78.13 -42.14 32.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.018 -0.537 . . . . 72.34 110.268 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -70.03 -13.07 62.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.853 -0.612 . . . . 70.05 110.933 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.585 HG21 ' HD2' ' A' ' 65' ' ' HIS . 35.8 p -108.72 -16.07 14.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.179 -0.464 . . . . 51.13 111.195 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.29 30.65 17.11 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.793 0.33 . . . . 72.12 110.942 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -96.1 44.27 1.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 74.44 111.047 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.423 ' CD2' ' HD2' ' A' ' 6' ' ' PRO . 75.5 m-85 -66.86 175.95 2.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 65.12 110.696 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 72.23 110.879 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.439 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.784 0.326 . . . . 72.54 110.987 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -152.36 171.5 17.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.307 -0.406 . . . . 73.1 110.88 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' THR . . . . . 0.415 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 0.2 OUTLIER -134.52 129.22 34.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 75.41 110.56 179.828 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.41 ' CG ' ' HB3' ' A' ' 190' ' ' LEU . 0.0 OUTLIER -120.32 151.54 39.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 62.41 111.056 -179.776 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.401 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.3 m -150.08 114.1 5.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.144 -0.48 . . . . 71.44 110.875 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.61 ' O ' HG13 ' A' ' 115' ' ' VAL . 9.7 p -80.7 106.6 12.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.249 -0.432 . . . . 75.35 111.134 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.401 HD12 ' O ' ' A' ' 114' ' ' SER . 6.4 mp -78.31 -77.11 0.17 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.476 . . . . 61.51 111.076 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -96.76 110.0 22.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.267 -0.424 . . . . 74.11 111.08 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.2 mtmt -59.43 139.6 56.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 64.32 110.804 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.514 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -111.68 -154.78 12.88 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.682 -0.77 . . . . 24.21 112.659 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -37.29 -52.92 1.09 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.049 0.452 . . . . 44.51 111.412 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 tmtp? 71.85 36.17 1.24 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.793 -0.64 . . . . 71.42 110.234 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -156.91 -44.61 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.791 -0.64 . . . . 73.35 110.775 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -87.59 97.08 10.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.117 -0.492 . . . . 72.53 110.919 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -109.41 154.82 42.04 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.089 -0.505 . . . . 75.13 110.642 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.69 ' HB2' HG21 ' A' ' 166' ' ' VAL . 58.5 Cg_endo -71.59 125.47 11.2 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.515 2.143 . . . . 65.33 112.439 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.1 tttm -92.99 160.22 14.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 75.22 110.899 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -57.89 119.47 6.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.286 -0.415 . . . . 72.14 110.947 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 87.45 1.8 83.21 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.745 -0.74 . . . . 75.11 112.833 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -92.13 139.41 30.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.878 0.37 . . . . 74.33 110.967 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.524 HG22 ' N ' ' A' ' 131' ' ' VAL . 4.4 p -71.66 162.04 4.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.066 -0.515 . . . . 75.03 110.909 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.699 HG12 HG23 ' A' ' 223' ' ' ILE . 9.3 m -154.56 145.58 13.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.042 -0.526 . . . . 52.02 110.987 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.452 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -128.35 117.95 22.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.728 0.299 . . . . 75.05 110.936 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.455 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 29.1 p -154.26 170.3 21.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.919 0.39 . . . . 33.5 111.196 -179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.61 ' HB3' HD11 ' A' ' 149' ' ' ILE . 66.3 m95 -104.19 161.01 14.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.938 -0.574 . . . . 74.52 110.149 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.506 ' OH ' HD13 ' A' ' 162' ' ' LEU . 4.5 p90 -159.5 134.98 8.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.03 0.443 . . . . 73.42 111.702 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' THR . . . . . 1.043 HG21 HG11 ' A' ' 5' ' ' VAL . 22.5 m -127.83 113.55 16.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 70.52 110.307 179.467 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.601 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.18 144.2 17.06 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.629 -0.796 . . . . 53.53 113.342 -179.272 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.84 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.44 130.77 13.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.756 0.312 . . . . 62.14 110.457 179.675 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.66 HD21 HG23 ' A' ' 208' ' ' ILE . 91.3 mt -66.02 -178.0 0.56 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.395 -0.366 . . . . 70.13 110.849 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -56.7 -42.3 78.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 75.33 110.76 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.46 -5.22 56.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.97 -0.559 . . . . 73.11 111.395 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 95.89 25.76 12.62 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.624 -0.798 . . . . 65.12 112.634 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' THR . . . . . 0.645 ' HB ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -80.89 113.02 18.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.876 0.37 . . . . 72.1 110.837 180.0 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.479 ' CG2' HG23 ' A' ' 147' ' ' THR . 11.3 p -71.6 121.42 21.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 73.42 111.136 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.442 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 53.3 p90 -113.28 -17.08 12.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 50.33 111.315 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.09 127.52 7.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.797 0.332 . . . . 73.42 110.951 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.874 HG22 HG23 ' A' ' 136' ' ' THR . 1.0 OUTLIER -142.87 98.01 3.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 73.22 111.005 -179.992 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -77.26 -9.16 58.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.224 -0.444 . . . . 73.52 111.075 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.693 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.5 mp . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.383 -0.371 . . . . 51.32 110.962 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.796 0.331 . . . . 74.41 111.092 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -129.83 128.4 22.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 74.22 110.89 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.09 148.2 40.65 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.411 2.074 . . . . 74.2 112.314 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.506 HD13 ' OH ' ' A' ' 135' ' ' TYR . 0.3 OUTLIER -73.47 120.76 19.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 50.54 110.532 179.797 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.644 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -103.55 122.7 45.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.944 0.402 . . . . 64.34 111.336 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.655 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 25.2 p90 -153.74 145.58 23.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.002 -0.544 . . . . 74.44 110.637 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.452 ' HB3' HG21 ' A' ' 168' ' ' VAL . 60.9 mttt -80.75 138.49 36.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.128 0.489 . . . . 73.3 111.29 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.69 HG21 ' HB2' ' A' ' 125' ' ' PRO . 17.8 m -87.27 149.35 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.652 -0.704 . . . . 73.24 111.05 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.0 23.7 76.91 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.777 -0.725 . . . . 73.22 112.408 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.452 HG21 ' HB3' ' A' ' 165' ' ' LYS . 0.8 OUTLIER -132.55 39.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.939 0.4 . . . . 62.32 110.926 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 47.36 38.77 13.34 Favored Glycine 0 C--N 1.33 0.202 0 C-N-CA 121.02 -0.609 . . . . 61.22 112.85 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.5 -47.05 11.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.915 0.388 . . . . 72.4 110.872 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 171' ' ' VAL . . . . . 0.466 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.2 OUTLIER -120.08 -179.68 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.96 -0.564 . . . . 74.35 111.022 179.898 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.522 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 4.0 pt -59.64 161.02 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.32 -0.4 . . . . 73.22 111.285 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -69.07 -27.88 66.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 75.2 110.986 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.83 -37.75 38.29 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.673 -0.775 . . . . 62.3 112.03 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.695 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.7 t90 -78.44 -33.43 48.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.921 0.391 . . . . 74.44 111.09 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -69.05 -29.05 67.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.973 -0.558 . . . . 64.41 110.695 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -81.76 -28.72 33.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 75.42 110.827 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.568 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -85.27 -51.55 6.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.277 -0.42 . . . . 73.24 111.212 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.655 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 2.9 mt -54.39 -36.71 64.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.991 -0.55 . . . . 75.12 110.773 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 3.1 tp -54.15 -25.02 20.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 70.24 110.996 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.16 -0.0 57.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 60.11 111.445 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 23.2 mmm -80.54 150.14 29.7 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.867 0.365 . . . . 55.31 110.909 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.52 171.08 8.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.104 -0.498 . . . . 71.31 111.18 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 184' ' ' LYS . . . . . 0.511 ' HA ' HD22 ' A' ' 220' ' ' LEU . 3.6 tttt -62.7 117.1 5.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.037 -0.529 . . . . 63.13 110.68 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 185' ' ' GLY . . . . . 0.401 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 69.07 65.63 2.54 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.617 -0.802 . . . . 72.41 112.398 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 186' ' ' GLU . . . . . 0.514 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.5 tt0 -145.05 145.14 31.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.663 0.268 . . . . 63.0 110.503 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.9 ttpt -118.36 135.88 54.06 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.194 -0.299 . . . . 70.34 110.194 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -144.43 172.82 12.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.125 0.488 . . . . 73.31 111.864 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.52 118.22 14.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.53 -0.759 . . . . 71.53 109.817 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.696 HD21 ' CE1' ' A' ' 216' ' ' PHE . 2.1 pt? -128.73 139.84 52.02 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.016 0.436 . . . . 65.24 111.795 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.559 ' HB3' HG23 ' A' ' 215' ' ' THR . 0.0 OUTLIER -117.79 114.87 23.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.792 -0.64 . . . . 75.24 110.544 179.549 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.449 HD13 HD11 ' A' ' 172' ' ' ILE . 3.1 mt -105.0 142.43 18.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.229 -0.441 . . . . 61.25 111.521 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.433 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.3 OUTLIER -72.05 168.57 21.78 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.907 -0.588 . . . . 74.25 110.592 179.818 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 194' ' ' PRO . . . . . 0.433 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 24.7 Cg_endo -61.93 -35.07 79.56 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.352 2.035 . . . . 61.03 112.224 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -60.37 -39.91 88.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 71.12 111.099 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.439 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 16.8 m0 -96.98 36.87 1.36 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.343 -0.39 . . . . 64.0 110.974 -179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -160.8 -78.45 0.05 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.067 -0.515 . . . . 61.34 110.742 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 198' ' ' TYR . . . . . 0.589 ' CE2' HD13 ' A' ' 208' ' ' ILE . 36.0 m-85 -105.98 -71.25 0.75 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 74.34 110.535 179.531 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 141.03 -177.21 21.11 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.815 -0.707 . . . . 32.35 112.85 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 18.4 mttm -59.21 -34.65 72.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.816 0.341 . . . . 72.43 110.932 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -61.57 -52.8 62.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 50.02 110.64 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 97.17 173.6 34.29 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.874 -0.679 . . . . 73.22 112.551 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.425 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.3 OUTLIER -111.23 93.51 18.61 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.654 0.264 . . . . 75.14 110.743 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.97 -26.37 51.32 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.527 2.151 . . . . 64.43 112.443 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -60.86 -42.18 97.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.946 0.403 . . . . 74.43 110.849 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -99.21 27.43 5.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.043 -0.526 . . . . 75.34 111.231 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.1 29.44 14.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.27 -0.423 . . . . 74.02 111.038 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.66 HG23 HD21 ' A' ' 139' ' ' LEU . 40.6 mt -94.14 111.46 53.39 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.317 -0.401 . . . . 62.52 110.987 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.33 172.32 6.65 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.554 2.169 . . . . 74.21 112.25 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.2 128.64 12.31 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.612 2.208 . . . . 72.33 112.241 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 5.5 m120 63.26 69.54 0.57 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.3 -0.409 . . . . 53.14 110.711 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.68 156.98 34.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 43.13 111.39 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -88.57 141.72 28.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.962 -0.563 . . . . 53.33 110.381 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.457 HD11 ' CD2' ' A' ' 198' ' ' TYR . 3.5 mt -125.68 109.07 12.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.379 . . . . 70.33 111.518 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.559 HG23 ' HB3' ' A' ' 191' ' ' GLU . 4.3 m -113.07 142.9 45.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.953 -0.567 . . . . 44.42 110.511 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.696 ' CE1' HD21 ' A' ' 190' ' ' LEU . 18.4 p90 -155.08 -179.86 8.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.438 . . . . 74.54 111.371 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -132.53 135.96 46.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.702 -0.681 . . . . 73.4 110.409 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.695 HG21 ' HE1' ' A' ' 175' ' ' TRP . 4.2 t -121.14 150.9 24.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.098 0.475 . . . . 64.42 111.809 -178.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -136.74 107.96 6.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.654 -0.703 . . . . 72.21 110.163 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.736 HD21 HG13 ' A' ' 223' ' ' ILE . 2.3 tt -69.99 130.0 41.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.426 -0.352 . . . . 64.44 110.809 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 24.7 t -108.8 -30.14 2.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.253 -0.43 . . . . 73.23 111.423 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 222' ' ' ASP . . . . . 0.431 ' N ' HD23 ' A' ' 220' ' ' LEU . 7.8 t70 -170.0 160.16 8.1 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.901 0.381 . . . . 64.44 111.236 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.736 HG13 HD21 ' A' ' 220' ' ' LEU . 31.9 mt -142.83 111.82 2.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.03 -0.532 . . . . 54.35 111.014 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 224' ' ' ASP . . . . . 0.434 ' C ' HG12 ' A' ' 130' ' ' VAL . 1.1 m-20 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.243 -0.435 . . . . 74.43 110.902 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.939 HG11 HG21 ' A' ' 136' ' ' THR . 40.0 t . . . . . 0 CA--C 1.529 0.139 0 CA-C-O 120.515 0.197 . . . . 41.45 110.846 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.451 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 88.9 Cg_endo -80.9 140.2 12.6 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.622 2.215 . . . . 72.05 112.623 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -83.87 154.62 23.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 62.42 110.863 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.57 89.92 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.114 -0.493 . . . . 65.42 111.47 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.83 -32.38 67.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 62.4 111.18 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.557 ' NE1' HD11 ' A' ' 20' ' ' LEU . 1.9 m-90 -118.63 173.86 6.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 74.33 110.927 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.465 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -116.66 153.08 32.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.962 -0.563 . . . . 70.25 110.424 179.542 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.408 HG12 ' HD2' ' A' ' 16' ' ' ARG . 24.1 t -55.96 -33.74 36.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.926 0.394 . . . . 55.11 111.009 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -71.13 -27.67 63.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.986 -0.552 . . . . 72.03 111.286 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.465 ' HB2' HG23 ' A' ' 11' ' ' THR . 0.0 OUTLIER -82.34 -56.38 3.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.811 0.339 . . . . 73.35 111.208 -179.82 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.763 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.2 mt -49.51 -65.07 0.63 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.245 -0.434 . . . . 61.12 111.228 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.408 ' HD2' HG12 ' A' ' 12' ' ' VAL . 16.0 mtt180 -53.55 -25.1 15.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 71.21 111.258 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.69 172.72 0.16 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.941 0.401 . . . . 72.31 111.239 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -110.3 16.84 21.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.92 -0.582 . . . . 53.4 111.254 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -111.34 -23.58 10.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.568 -0.287 . . . . 71.52 111.224 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.849 HD22 HD11 ' A' ' 25' ' ' ILE . 10.1 tt -87.12 116.52 66.35 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.458 -0.337 . . . . 62.25 110.921 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.45 123.27 13.22 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.384 2.056 . . . . 55.45 112.237 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.4 -24.11 66.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 72.23 111.308 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -53.16 -35.24 59.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.421 -0.354 . . . . 64.23 111.295 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -77.56 -49.74 14.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.287 -0.415 . . . . 72.11 110.921 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.849 HD11 HD22 ' A' ' 20' ' ' LEU . 25.1 mt -47.03 -36.91 3.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.898 -0.592 . . . . 72.23 111.246 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.736 HG12 HD21 ' A' ' 59' ' ' LEU . 10.7 mt -72.04 -49.26 45.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 42.31 110.848 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.539 ' HG3' HD11 ' A' ' 47' ' ' ILE . 0.7 OUTLIER -57.23 -23.43 48.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.69 -0.687 . . . . 71.42 111.098 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -74.23 -49.78 21.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.002 0.43 . . . . 73.5 111.061 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.789 HD21 ' HA ' ' A' ' 63' ' ' TYR . 3.5 mt -66.3 -28.55 68.77 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.872 -0.603 . . . . 44.44 111.291 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -76.21 -28.01 57.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.52 -0.309 . . . . 64.44 111.016 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.423 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 10.7 pt-20 -89.91 -38.48 13.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.832 0.348 . . . . 71.32 110.817 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.451 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 42.4 m170 -100.49 16.61 24.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 64.32 110.982 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.6 152.11 21.49 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.831 -0.7 . . . . 63.44 112.512 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.8 p -92.73 156.52 16.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.642 0.258 . . . . 75.42 110.604 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.438 ' HA ' HD21 ' A' ' 44' ' ' LEU . 1.4 m-20 -48.0 -54.68 12.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.765 0.316 . . . . 65.23 111.31 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 82.5 p -51.06 -46.69 61.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.023 0.439 . . . . 75.33 110.695 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 22.2 t80 -57.11 -48.18 79.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.745 -0.661 . . . . 64.14 110.775 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.751 HD22 ' HB3' ' A' ' 43' ' ' LEU . 11.8 mt -63.24 -46.87 84.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 71.53 110.909 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.913 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -49.46 -31.05 9.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 41.25 111.243 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -72.92 -32.46 65.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 71.21 111.073 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.707 ' ND1' ' HB2' ' A' ' 62' ' ' ALA . 6.7 m-70 -110.14 12.14 23.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.377 -0.374 . . . . 75.44 111.548 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 59.96 32.13 20.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.747 0.308 . . . . 70.32 111.01 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.751 ' HB3' HD22 ' A' ' 38' ' ' LEU . 15.5 mt -85.93 -22.05 27.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.257 -0.429 . . . . 74.12 111.042 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.913 HD11 ' HB2' ' A' ' 39' ' ' ALA . 92.4 mt -48.01 170.47 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.931 0.396 . . . . 63.11 111.234 179.509 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.88 -160.13 32.15 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.846 -0.692 . . . . 63.23 112.796 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.877 ' O ' HG23 ' A' ' 50' ' ' VAL . 36.7 m-80 -102.62 147.11 27.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.963 0.411 . . . . 72.44 111.065 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.587 HG23 HD12 ' A' ' 26' ' ' ILE . 3.3 mp -45.36 -43.59 3.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.889 -0.596 . . . . 74.34 111.513 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -43.15 72.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.981 -0.554 . . . . 73.35 111.047 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -85.68 -28.95 24.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.956 -0.565 . . . . 73.24 111.22 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.877 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.8 t -73.01 -27.57 24.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.299 -0.41 . . . . 74.14 111.454 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.51 -25.86 66.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.427 -0.351 . . . . 54.35 111.359 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.25 -27.38 15.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.287 -0.415 . . . . 75.31 111.244 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.4 m -84.33 -21.43 30.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.353 -0.385 . . . . 74.33 111.414 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -120.58 131.48 54.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.795 0.331 . . . . 72.13 111.349 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -77.81 -178.12 5.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 52.2 110.474 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.465 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -61.28 -58.42 8.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.816 0.341 . . . . 72.53 110.536 179.962 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.24 -26.72 67.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.143 -0.481 . . . . 72.45 110.664 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.67 -37.95 83.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.108 0.48 . . . . 72.4 110.249 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.736 HD21 HG12 ' A' ' 26' ' ' ILE . 14.2 mt -76.25 -31.71 58.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.614 -0.721 . . . . 73.11 110.955 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.763 HG22 ' HB3' ' A' ' 15' ' ' LEU . 15.1 t -78.46 -42.81 26.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.051 0.453 . . . . 71.34 110.705 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 32.8 m -59.27 -35.6 74.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.842 -0.617 . . . . 72.51 110.493 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.707 ' HB2' ' ND1' ' A' ' 41' ' ' HIS . . . -81.76 -20.85 38.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.024 -0.535 . . . . 74.24 110.957 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.789 ' HA ' HD21 ' A' ' 29' ' ' LEU . 8.2 t80 -83.67 -22.99 31.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.194 -0.457 . . . . 71.52 110.86 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.508 ' ND2' HG12 ' A' ' 60' ' ' VAL . 37.1 m-80 -85.6 -53.91 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 74.24 111.369 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.449 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.2 p-80 -60.99 -28.29 68.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.111 -0.495 . . . . 73.43 111.136 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.67 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.8 tt -50.27 -40.51 48.35 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.977 0.417 . . . . 62.22 110.973 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.418 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.4 m-85 -78.95 -37.48 39.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.892 -0.594 . . . . 63.31 110.578 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.04 -40.47 91.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.893 -0.594 . . . . 74.31 110.999 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.01 -9.53 48.29 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.076 -0.511 . . . . 71.54 111.278 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.59 33.73 19.79 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.741 0.305 . . . . 74.23 111.244 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -90.56 46.29 1.32 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.387 -0.37 . . . . 74.15 111.078 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.428 ' CE2' ' HD2' ' A' ' 6' ' ' PRO . 93.3 m-85 -67.32 169.77 8.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.293 -0.412 . . . . 75.25 110.742 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.1 ttmm . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.329 -0.396 . . . . 61.43 110.861 179.889 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.865 0.364 . . . . 75.52 110.893 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 6.2 p90 -173.03 153.82 2.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 53.53 110.897 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 19.7 m -115.85 130.55 56.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.276 -0.42 . . . . 72.22 110.327 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.527 ' HE2' HG22 ' A' ' 115' ' ' VAL . 4.6 tttt -127.65 144.85 51.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.926 0.393 . . . . 74.52 111.227 -179.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.3 m -142.51 119.81 11.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 74.52 110.681 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.527 HG22 ' HE2' ' A' ' 113' ' ' LYS . 27.5 t -80.29 106.36 11.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.431 . . . . 73.22 111.211 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.532 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -79.33 -49.36 12.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.214 -0.448 . . . . 71.1 110.795 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -121.8 107.99 12.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 75.34 110.957 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.6 mttm -63.03 143.63 57.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.223 -0.444 . . . . 71.44 110.895 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -106.15 -165.05 23.0 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.687 -0.768 . . . . 65.13 112.409 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -36.56 -42.57 0.36 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.846 0.355 . . . . 64.22 111.826 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.6 tttt 74.55 42.22 0.31 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.135 -0.484 . . . . 74.54 110.582 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 69.1 m -164.26 -43.37 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.946 -0.57 . . . . 62.12 110.722 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -86.83 101.12 13.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 72.11 110.911 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -120.24 147.67 45.47 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 72.23 110.834 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.456 ' CB ' HG21 ' A' ' 166' ' ' VAL . 50.7 Cg_exo -54.37 127.63 26.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.56 2.174 . . . . 54.2 112.547 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.56 ' O ' HG23 ' A' ' 166' ' ' VAL . 1.1 mttp -99.18 152.19 20.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 74.31 110.706 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.48 114.05 1.52 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.335 -0.393 . . . . 74.53 111.114 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 93.44 -2.37 70.64 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.762 -0.732 . . . . 62.45 112.982 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -92.15 137.77 32.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.919 0.39 . . . . 71.0 111.071 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.518 HG22 ' N ' ' A' ' 131' ' ' VAL . 7.5 p -70.05 161.27 4.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.078 -0.51 . . . . 75.52 110.971 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.751 HG12 HG23 ' A' ' 223' ' ' ILE . 5.5 m -153.58 144.71 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 72.22 111.07 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.475 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.96 117.75 22.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.543 -0.299 . . . . 65.13 110.805 179.753 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.5 ' HA ' HG23 ' A' ' 221' ' ' VAL . 30.2 p -150.12 168.09 24.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.0 0.429 . . . . 53.14 111.182 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.718 ' HB3' HD11 ' A' ' 149' ' ' ILE . 51.3 m95 -101.89 157.76 16.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.813 -0.63 . . . . 73.11 109.747 179.326 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.471 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 49.8 p90 -162.45 139.06 7.78 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.296 -0.561 . . . . 64.15 112.22 -179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.939 HG21 HG11 ' A' ' 5' ' ' VAL . 81.1 m -129.26 112.48 13.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.466 -0.788 . . . . 71.24 110.457 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.648 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.73 146.15 18.11 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.598 -0.81 . . . . 62.23 113.184 -179.524 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.635 HG23 HG12 ' A' ' 144' ' ' VAL . 0.0 OUTLIER -152.21 147.1 26.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.789 0.328 . . . . 74.21 110.833 179.815 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.686 HD21 HD12 ' A' ' 208' ' ' ILE . 41.4 mt -80.5 -178.37 6.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 74.14 110.694 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -56.92 -43.82 81.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.901 0.382 . . . . 71.13 111.018 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.7 -6.61 47.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.996 -0.547 . . . . 65.4 111.462 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 92.43 20.45 35.04 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.666 -0.778 . . . . 63.54 112.729 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.48 113.8 25.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 73.11 110.675 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.635 HG12 HG23 ' A' ' 138' ' ' THR . 5.7 m -63.68 138.5 22.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 64.04 111.134 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.675 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 40.3 p90 -117.81 -40.96 2.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 60.45 110.929 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -154.53 115.2 3.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.067 -0.515 . . . . 75.03 110.715 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.406 ' CB ' ' HA ' ' A' ' 136' ' ' THR . 6.9 t -142.76 126.97 17.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.302 -0.408 . . . . 64.4 111.237 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.502 ' O ' HD13 ' A' ' 149' ' ' ILE . 24.1 t-20 -89.01 55.44 3.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.196 0.522 . . . . 73.32 109.915 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.718 HD11 ' HB3' ' A' ' 134' ' ' TRP . 45.3 mm . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.74 -0.664 . . . . 74.41 111.05 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.437 ' HB1' ' HH2' ' A' ' 134' ' ' TRP . . . . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.848 0.356 . . . . 73.24 111.094 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.4 tttt -146.34 116.06 4.65 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.446 . . . . 43.34 110.855 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 161' ' ' PRO . . . . . 0.42 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 53.8 Cg_exo -52.41 155.05 10.31 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.376 2.05 . . . . 65.54 112.258 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.65 117.83 16.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 75.12 110.517 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.637 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -100.6 123.31 44.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.939 0.399 . . . . 72.13 111.474 -179.733 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.704 ' O ' HG22 ' A' ' 131' ' ' VAL . 11.7 p90 -153.38 145.41 23.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.965 -0.561 . . . . 73.31 110.528 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.601 ' O ' HG22 ' A' ' 168' ' ' VAL . 9.6 mtpt -81.17 138.9 35.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.136 0.493 . . . . 75.33 111.248 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 126' ' ' LYS . 6.2 m -87.3 149.37 4.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.566 -0.743 . . . . 63.5 111.128 -179.434 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.63 22.82 78.04 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.836 -0.697 . . . . 74.34 112.6 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 165' ' ' LYS . 28.0 m -131.24 40.52 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.35 . . . . 65.42 111.111 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.52 38.06 6.94 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 121.071 -0.585 . . . . 53.03 113.135 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.51 -47.0 11.81 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.94 0.4 . . . . 64.22 110.983 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 171' ' ' VAL . . . . . 0.467 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.3 OUTLIER -119.0 -179.48 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.001 -0.545 . . . . 64.21 111.026 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.537 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.8 158.89 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.316 -0.402 . . . . 73.33 111.281 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 17.0 ttm105 -67.73 -27.88 67.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.271 -0.422 . . . . 75.13 110.965 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.1 -38.06 48.17 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.694 -0.765 . . . . 72.11 111.881 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.775 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.2 t90 -78.6 -33.0 47.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.993 0.425 . . . . 74.11 110.883 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 176' ' ' ASP . . . . . 0.402 ' O ' HD13 ' A' ' 180' ' ' LEU . 35.9 t70 -64.91 -32.17 73.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.877 -0.601 . . . . 72.24 110.538 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -80.84 -28.93 35.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.055 -0.52 . . . . 71.31 110.665 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.533 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -80.7 -56.36 4.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 65.33 111.059 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.691 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 6.2 mt -56.01 -31.3 62.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.924 -0.58 . . . . 61.44 110.797 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.402 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.4 tp -53.41 -28.88 32.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.085 -0.507 . . . . 72.34 111.344 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 27.1 p -105.65 4.59 30.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.372 -0.376 . . . . 74.52 111.793 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.474 ' O ' HD13 ' A' ' 220' ' ' LEU . 5.3 mtp -74.33 101.98 4.23 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.903 0.383 . . . . 75.15 110.89 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.9 161.39 18.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.927 -0.579 . . . . 72.3 111.409 -179.059 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 184' ' ' LYS . . . . . 0.642 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -60.86 117.65 5.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.56 -0.745 . . . . 74.13 111.2 -179.769 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 81.65 10.42 84.33 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.869 -0.682 . . . . 64.05 113.137 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -86.18 151.07 23.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 71.21 111.27 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -127.42 138.16 52.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.998 -0.546 . . . . 64.4 109.976 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.05 172.5 13.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.226 0.536 . . . . 75.34 112.147 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.82 101.09 4.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.391 -0.822 . . . . 75.13 109.715 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.533 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.6 pt? -122.18 147.94 45.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.121 0.486 . . . . 70.1 111.881 -179.04 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.619 ' HB3' HG23 ' A' ' 215' ' ' THR . 10.5 pt-20 -120.47 120.53 36.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.705 -0.68 . . . . 64.12 110.564 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.471 ' CD1' ' CZ ' ' A' ' 216' ' ' PHE . 5.0 mp -100.49 139.46 21.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 64.55 111.347 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -77.0 164.88 56.41 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.933 -0.576 . . . . 72.21 110.756 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 194' ' ' PRO . . . . . 0.41 ' HG3' ' N ' ' A' ' 212' ' ' ALA . 53.1 Cg_exo -54.93 -42.0 73.25 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.588 2.192 . . . . 72.34 112.303 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -52.29 -30.41 27.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 72.03 111.379 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.461 ' O ' HG21 ' A' ' 192' ' ' ILE . 23.7 m0 -115.6 36.95 3.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.404 -0.362 . . . . 74.32 111.227 -179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -154.93 -85.2 0.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.447 -0.342 . . . . 71.41 111.25 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 198' ' ' TYR . . . . . 0.519 ' HD2' HG21 ' A' ' 208' ' ' ILE . 28.7 m-85 -107.55 -33.47 7.32 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.043 0.449 . . . . 75.42 110.624 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 109.29 173.1 20.95 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.912 -0.661 . . . . 31.11 112.821 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -32.57 70.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.788 0.328 . . . . 62.04 110.831 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -56.78 -54.71 43.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.203 -0.453 . . . . 64.33 110.643 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 117.87 -162.4 13.08 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.833 -0.699 . . . . 72.02 112.673 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.438 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 1.6 tm0? -153.02 84.99 4.37 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.85 0.357 . . . . 70.23 110.355 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -48.67 -49.67 14.26 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.803 2.335 . . . . 71.34 113.048 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -50.93 -42.32 59.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.914 0.388 . . . . 72.14 111.088 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.675 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -95.65 26.75 3.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.033 -0.53 . . . . 73.35 111.384 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 4.0 mptt 47.84 30.68 1.99 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.83 0.348 . . . . 65.44 111.075 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.686 HD12 HD21 ' A' ' 139' ' ' LEU . 22.7 mm -92.81 111.71 52.48 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 74.25 111.28 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 209' ' ' PRO . . . . . 0.567 ' HG2' ' HB2' ' A' ' 212' ' ' ALA . 74.4 Cg_endo -74.99 160.88 39.67 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.414 2.076 . . . . 75.31 112.17 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -51.33 115.3 1.98 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.473 2.115 . . . . 71.3 112.298 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 66.24 73.53 0.37 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.232 -0.44 . . . . 62.34 110.912 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 212' ' ' ALA . . . . . 0.567 ' HB2' ' HG2' ' A' ' 209' ' ' PRO . . . -126.22 124.68 40.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.248 -0.433 . . . . 74.03 111.329 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 3.8 tptm -65.67 151.82 45.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.106 -0.497 . . . . 72.51 110.578 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 6.1 mt -130.48 109.42 10.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.814 0.34 . . . . 70.33 111.405 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.619 HG23 ' HB3' ' A' ' 191' ' ' GLU . 3.8 m -106.38 139.72 40.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 62.53 110.573 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.648 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 6.4 p90 -156.44 178.75 9.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.107 0.48 . . . . 62.31 111.514 -179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -133.01 137.13 46.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.613 -0.721 . . . . 74.34 110.279 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.775 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.3 t -124.15 151.26 29.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.107 0.48 . . . . 54.35 112.086 -178.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -136.88 110.98 8.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.598 -0.728 . . . . 61.25 110.132 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.792 HD21 HG13 ' A' ' 223' ' ' ILE . 2.9 tt -70.83 128.04 34.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.84 0.352 . . . . 70.11 110.988 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.5 HG23 ' HA ' ' A' ' 133' ' ' CYS . 15.5 t -104.97 -30.43 2.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.125 -0.488 . . . . 60.12 111.571 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -171.21 162.46 6.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.867 0.365 . . . . 74.31 111.239 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.792 HG13 HD21 ' A' ' 220' ' ' LEU . 30.2 mt -143.49 112.23 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.006 -0.543 . . . . 64.15 110.964 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 224' ' ' ASP . . . . . 0.491 ' C ' HG12 ' A' ' 130' ' ' VAL . 3.3 m-20 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 72.44 110.89 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 1.091 HG11 HG21 ' A' ' 136' ' ' THR . 38.5 t . . . . . 0 CA--C 1.528 0.123 0 CA-C-O 120.661 0.267 . . . . 73.32 111.217 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -77.12 132.89 13.04 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.731 2.287 . . . . 72.25 112.401 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.8 ' OE1' HD11 ' A' ' 149' ' ' ILE . 7.2 mm100 -79.79 146.54 32.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 71.12 110.943 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.523 ' HE ' HG23 ' A' ' 149' ' ' ILE . 0.0 OUTLIER -50.81 115.63 1.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.036 -0.529 . . . . 74.32 111.192 -179.829 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.43 ' HB2' ' NZ ' ' A' ' 187' ' ' LYS . . . -89.25 -39.39 13.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.226 -0.443 . . . . 70.11 110.871 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.517 ' NE1' HD21 ' A' ' 20' ' ' LEU . 1.5 m-90 -104.36 160.05 15.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.023 -0.535 . . . . 72.14 110.703 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 m -99.26 151.87 20.55 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.048 -0.524 . . . . 60.1 110.533 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.635 ' HA ' HD12 ' A' ' 15' ' ' LEU . 44.0 t -56.67 -37.0 50.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.922 0.392 . . . . 75.52 110.437 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.403 ' O ' ' HB2' ' A' ' 17' ' ' SER . 2.1 tt0 -66.02 -27.4 68.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.962 -0.563 . . . . 72.54 110.86 179.5 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.544 ' OE1' HD23 ' A' ' 20' ' ' LEU . 6.3 mt-30 -80.08 -54.53 5.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.985 -0.552 . . . . 73.21 111.564 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.756 ' HB3' HG22 ' A' ' 60' ' ' VAL . 2.0 mt -50.07 -66.69 0.35 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.727 0.298 . . . . 71.33 111.797 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 12' ' ' VAL . 1.5 ptm180 -60.59 -26.21 66.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.383 -0.371 . . . . 71.31 111.371 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.433 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.4 OUTLIER -50.85 177.28 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.928 0.394 . . . . 55.51 111.273 -179.92 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.19 16.68 21.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.946 -0.57 . . . . 74.31 111.107 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -117.6 -19.32 9.44 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.418 -0.356 . . . . 71.13 111.273 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 1.122 HD12 HD11 ' A' ' 25' ' ' ILE . 1.6 tm? -84.58 121.74 74.87 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.508 -0.315 . . . . 64.43 110.852 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.656 ' HD2' HD22 ' A' ' 20' ' ' LEU . 43.7 Cg_endo -67.84 123.25 10.49 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.428 2.086 . . . . 62.34 112.369 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.624 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -66.15 -24.23 66.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.11 -0.495 . . . . 61.33 111.403 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -53.43 -45.56 69.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.411 -0.358 . . . . 75.34 111.494 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.98 -23.29 48.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.162 -0.472 . . . . 71.43 111.475 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 1.122 HD11 HD12 ' A' ' 20' ' ' LEU . 57.1 mt -70.74 -43.22 77.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.925 0.393 . . . . 74.23 111.127 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.744 ' HB ' HG23 ' A' ' 47' ' ' ILE . 4.0 mt -68.72 -40.19 81.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.017 -0.538 . . . . 73.43 111.102 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -67.18 -25.83 66.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.001 -0.545 . . . . 75.04 111.062 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -70.04 -43.76 70.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.033 0.444 . . . . 54.05 110.875 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.562 HD21 ' HA ' ' A' ' 63' ' ' TYR . 2.8 mt -72.79 -21.35 61.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.888 -0.597 . . . . 74.42 111.04 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -82.68 -24.13 33.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.412 -0.358 . . . . 75.0 111.029 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.82 1.65 31.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.374 -0.375 . . . . 72.42 111.417 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -131.86 -10.66 3.45 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.687 0.255 . . . . 71.51 111.687 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.81 167.66 12.48 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.738 -0.744 . . . . 51.31 112.41 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.7 p -93.86 149.87 20.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.58 0.229 . . . . 74.12 110.489 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.624 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -48.07 -56.98 6.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.807 0.337 . . . . 74.55 110.994 -179.75 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.2 m -48.41 -50.7 29.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 72.15 110.832 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.512 ' CE2' HD12 ' A' ' 66' ' ' LEU . 17.6 t80 -54.06 -48.03 71.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.853 -0.612 . . . . 70.43 110.492 179.605 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.411 HD22 ' HB3' ' A' ' 43' ' ' LEU . 13.2 mt -66.71 -41.79 87.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.094 -0.503 . . . . 72.31 110.784 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.808 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.57 -47.71 28.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.989 0.423 . . . . 63.43 111.206 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -57.51 -27.22 62.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.812 -0.631 . . . . 74.44 110.982 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -112.53 9.81 19.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.314 -0.403 . . . . 62.01 111.231 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.4 37.77 28.27 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.94 0.4 . . . . 64.32 110.664 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.696 HD21 HD23 ' A' ' 59' ' ' LEU . 17.7 mt -95.94 -19.74 19.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.986 -0.552 . . . . 61.44 111.851 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.808 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -82.11 155.76 24.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.078 0.466 . . . . 71.33 111.101 -179.853 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.37 -122.63 5.5 Favored Glycine 0 N--CA 1.452 -0.292 0 CA-C-N 115.648 -0.705 . . . . 74.43 112.429 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.667 ' O ' HG23 ' A' ' 50' ' ' VAL . 6.0 m-80 -116.34 115.43 25.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.736 0.303 . . . . 63.45 111.059 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.744 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.5 mp -44.85 -53.5 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.178 -0.465 . . . . 75.1 111.447 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.56 -37.2 7.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.868 -0.605 . . . . 75.44 111.05 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -85.69 -26.58 25.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 72.11 111.255 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.667 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.4 t -82.79 -26.56 8.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.432 -0.349 . . . . 71.52 111.597 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.95 -17.85 64.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.427 -0.351 . . . . 61.34 111.454 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 ptpt -95.06 -31.96 13.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.445 -0.343 . . . . 71.2 111.09 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -87.88 -33.68 18.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.24 -0.436 . . . . 75.21 111.131 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -91.21 128.58 37.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.29 -0.414 . . . . 71.21 111.239 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -84.88 178.63 7.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 53.1 110.678 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.576 ' O ' HG23 ' A' ' 60' ' ' VAL . 2.4 tptt -60.03 -58.1 10.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.91 0.386 . . . . 75.34 110.653 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -27.4 69.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.072 -0.513 . . . . 63.54 110.522 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.02 -41.45 96.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 32.13 110.431 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.696 HD23 HD21 ' A' ' 43' ' ' LEU . 20.3 mt -75.55 -30.15 59.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.7 -0.682 . . . . 74.52 110.99 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.756 HG22 ' HB3' ' A' ' 15' ' ' LEU . 18.8 t -78.26 -42.91 27.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.305 -0.407 . . . . 73.5 110.93 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.7 m -61.98 -33.92 75.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.948 -0.569 . . . . 72.43 110.792 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.423 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -80.86 -23.49 39.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 62.14 111.107 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.562 ' HA ' HD21 ' A' ' 29' ' ' LEU . 71.8 t80 -83.66 -22.86 32.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 74.11 110.953 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -82.88 -54.65 4.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.048 -0.524 . . . . 63.54 111.373 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.487 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 3.4 p-80 -63.0 -26.0 68.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.072 -0.513 . . . . 74.32 111.433 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.668 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.6 tt -54.57 -39.04 67.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.847 0.356 . . . . 73.1 111.026 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.422 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 5.2 m-85 -78.98 -38.16 37.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.106 -0.497 . . . . 70.32 110.574 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.63 -40.53 84.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.97 -0.559 . . . . 70.03 110.78 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 75.1 p -90.34 -4.66 56.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.95 -0.568 . . . . 72.13 111.467 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 48.36 37.73 9.19 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.703 0.287 . . . . 55.5 111.287 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.433 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 41.2 mtt180 -94.25 44.03 1.11 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.38 -0.373 . . . . 75.25 111.115 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.419 ' HA ' HD21 ' A' ' 66' ' ' LEU . 81.5 m-85 -65.69 -178.29 0.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 62.42 110.783 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.289 -0.414 . . . . 63.13 110.948 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.441 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.757 0.313 . . . . 74.54 110.987 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 45.0 p90 -154.89 -176.81 6.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 74.43 110.81 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -161.46 104.93 1.26 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.332 -0.394 . . . . 61.14 110.733 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.405 ' HB2' ' CD1' ' A' ' 190' ' ' LEU . 2.7 ptmm? -98.46 151.4 20.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.983 0.42 . . . . 72.23 111.241 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 2.1 m -148.61 111.67 4.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.887 -0.597 . . . . 74.51 110.391 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 26.1 t -73.58 106.29 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.305 -0.407 . . . . 75.52 111.324 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.822 HD12 ' HA ' ' A' ' 188' ' ' ALA . 3.5 mp -75.54 -32.02 60.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 63.24 110.508 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.7 tttt -140.35 110.47 6.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.036 -0.529 . . . . 62.24 110.668 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.0 tptt -57.99 134.76 56.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.262 -0.426 . . . . 71.44 110.968 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.513 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -108.63 -155.08 17.23 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.713 -0.756 . . . . 75.32 112.425 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -36.07 -53.44 0.78 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.008 0.432 . . . . 63.42 111.445 -179.384 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 70.87 33.71 2.12 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.816 -0.629 . . . . 72.42 110.248 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 62.7 m -154.51 -45.13 0.09 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.753 -0.658 . . . . 54.2 110.683 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -89.08 92.57 9.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.119 -0.492 . . . . 63.5 110.84 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -102.83 154.91 37.18 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.117 -0.492 . . . . 61.23 110.847 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.709 ' HB2' HG21 ' A' ' 166' ' ' VAL . 53.9 Cg_endo -69.73 125.5 12.23 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.522 2.148 . . . . 62.2 112.332 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.432 ' O ' HG23 ' A' ' 166' ' ' VAL . 0.1 OUTLIER -96.44 152.42 18.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 75.12 110.925 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.48 118.98 6.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 74.14 110.859 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 97.36 -16.04 61.28 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.699 -0.763 . . . . 74.22 112.606 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -84.09 140.41 31.83 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.876 0.369 . . . . 74.0 110.969 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.557 HG12 ' C ' ' A' ' 224' ' ' ASP . 8.4 p -71.04 163.45 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 75.25 111.041 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.883 HG22 ' O ' ' A' ' 164' ' ' PHE . 13.0 m -154.91 146.26 13.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.171 -0.468 . . . . 74.02 111.063 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.601 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.0 OUTLIER -128.01 117.76 22.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.718 0.294 . . . . 75.1 110.838 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.465 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 26.1 p -155.27 170.18 22.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.927 0.394 . . . . 64.41 111.047 -179.623 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.771 ' HB3' HD13 ' A' ' 149' ' ' ILE . 38.2 m95 -106.08 164.6 11.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.949 -0.569 . . . . 74.22 110.308 179.584 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.504 ' OH ' HD13 ' A' ' 162' ' ' LEU . 12.3 p90 -162.08 137.07 7.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.926 0.394 . . . . 71.41 111.433 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' THR . . . . . 1.091 HG21 HG11 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -128.06 114.07 16.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.949 -0.568 . . . . 74.21 110.466 179.741 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.614 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.64 144.78 17.44 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.615 -0.802 . . . . 73.51 113.407 -179.184 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.885 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.95 136.78 18.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.702 0.286 . . . . 64.15 110.367 179.608 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 1.019 HD21 HD12 ' A' ' 208' ' ' ILE . 17.1 mt -68.45 -179.05 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.857 0.36 . . . . 73.2 111.035 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -57.04 -41.78 79.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.025 -0.534 . . . . 75.14 110.862 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.37 0.99 39.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 64.23 111.446 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 91.48 25.83 22.34 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.645 -0.788 . . . . 63.0 112.619 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.95 108.35 16.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.773 0.32 . . . . 75.3 110.835 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.418 HG13 ' O ' ' A' ' 144' ' ' VAL . 11.3 p -68.81 125.34 26.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 65.02 111.138 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.442 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 21.3 p90 -109.96 -22.2 11.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 73.1 111.002 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -162.06 137.9 7.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.401 -0.363 . . . . 75.15 110.836 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.905 HG23 HG23 ' A' ' 136' ' ' THR . 52.3 m -142.8 106.25 4.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 72.05 111.016 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.48 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 13.8 t30 -82.11 -14.81 55.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 71.34 111.226 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.8 HD11 ' OE1' ' A' ' 7' ' ' GLN . 25.4 mm . . . . . 0 C--N 1.332 -0.181 0 CA-C-O 120.822 0.344 . . . . 73.33 111.096 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.855 0.359 . . . . 73.22 111.038 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -145.01 135.29 11.9 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 71.25 110.887 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 161' ' ' PRO . . . . . 0.408 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 52.6 Cg_exo -54.68 163.49 3.86 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.445 2.097 . . . . 72.1 112.276 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.531 HD23 ' CD1' ' A' ' 164' ' ' PHE . 2.4 tt -84.54 119.41 25.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 72.42 110.595 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.626 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -95.17 121.79 37.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.897 0.379 . . . . 45.53 111.175 -179.93 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.883 ' O ' HG22 ' A' ' 131' ' ' VAL . 8.2 p90 -149.1 140.68 23.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.082 -0.508 . . . . 74.54 110.742 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.566 ' O ' HG22 ' A' ' 168' ' ' VAL . 56.1 mttt -80.68 137.41 36.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.076 0.465 . . . . 73.12 111.118 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.709 HG21 ' HB2' ' A' ' 125' ' ' PRO . 5.8 m -87.36 149.8 3.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.668 -0.696 . . . . 75.24 111.13 -179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.19 22.92 77.53 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.836 -0.697 . . . . 54.14 112.576 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.707 HG23 ' HG2' ' A' ' 170' ' ' LYS . 30.2 m -132.92 40.9 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.896 0.379 . . . . 52.52 111.032 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 49.12 38.85 26.0 Favored Glycine 0 CA--C 1.517 0.218 0 C-N-CA 120.936 -0.649 . . . . 71.14 112.896 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 170' ' ' LYS . . . . . 0.707 ' HG2' HG23 ' A' ' 168' ' ' VAL . 3.1 mmtt -83.02 -46.5 12.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.901 0.381 . . . . 75.1 110.78 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 171' ' ' VAL . . . . . 0.588 HG11 ' CE3' ' A' ' 175' ' ' TRP . 0.2 OUTLIER -123.35 -179.06 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.923 -0.581 . . . . 43.13 110.923 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.516 HD11 ' HB2' ' A' ' 175' ' ' TRP . 4.4 pt -57.16 161.37 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.316 -0.402 . . . . 53.04 111.382 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 31.8 ttm180 -69.7 -25.43 63.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 72.14 111.036 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -78.63 -38.55 23.98 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.743 -0.742 . . . . 51.44 112.187 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.648 ' HD1' HD23 ' A' ' 190' ' ' LEU . 3.4 t90 -75.66 -32.36 60.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.902 0.382 . . . . 64.52 111.36 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -72.04 -33.54 68.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.038 -0.528 . . . . 64.54 110.817 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -74.52 -28.98 61.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.115 -0.493 . . . . 63.13 110.83 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -87.98 -50.69 6.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.272 -0.422 . . . . 63.01 111.257 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.477 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 8.4 mt -52.55 -37.12 57.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.078 -0.51 . . . . 74.24 110.885 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 6.9 tp -50.97 -26.17 5.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.097 -0.501 . . . . 74.3 111.418 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.52 3.04 55.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.345 . . . . 73.43 111.624 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 4.7 ttt -79.95 148.99 30.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.752 0.311 . . . . 63.43 110.879 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -118.38 169.68 9.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.427 . . . . 73.13 111.26 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.76 118.52 8.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.859 -0.61 . . . . 73.0 110.659 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 68.01 64.1 3.31 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.687 -0.768 . . . . 43.44 112.476 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 186' ' ' GLU . . . . . 0.513 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 14.2 tt0 -144.02 147.7 34.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.575 0.226 . . . . 71.3 110.5 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 187' ' ' LYS . . . . . 0.529 ' HG2' HD13 ' A' ' 116' ' ' LEU . 6.1 tttt -115.94 132.83 56.53 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.066 -0.346 . . . . 74.14 110.066 179.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 188' ' ' ALA . . . . . 0.822 ' HA ' HD12 ' A' ' 116' ' ' LEU . . . -140.57 170.34 15.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.072 0.463 . . . . 73.25 111.729 -179.525 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 189' ' ' ARG . . . . . 0.568 ' HD3' HG23 ' A' ' 215' ' ' THR . 0.2 OUTLIER -123.08 101.39 7.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.653 -0.703 . . . . 72.05 109.892 179.548 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.648 HD23 ' HD1' ' A' ' 175' ' ' TRP . 4.9 mp -99.32 118.17 35.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.044 0.45 . . . . 75.3 112.106 -178.705 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.87 ' HG2' HG23 ' A' ' 215' ' ' THR . 9.4 mt-10 -110.72 107.71 17.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.666 -0.697 . . . . 62.44 109.574 178.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.454 HG12 ' CE2' ' A' ' 216' ' ' PHE . 3.6 mm -98.29 141.77 15.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.012 0.434 . . . . 74.01 111.639 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.402 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 2.0 mt-10 -81.53 166.66 36.65 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.868 -0.606 . . . . 70.31 110.372 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 194' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 21.1 Cg_endo -60.84 -48.72 9.96 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.427 2.084 . . . . 74.53 112.302 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -51.62 -26.32 8.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 54.52 111.442 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.441 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 10.1 m0 -117.61 37.02 4.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.487 -0.324 . . . . 75.44 111.216 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -158.01 -82.9 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.5 -0.318 . . . . 70.42 111.471 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 198' ' ' TYR . . . . . 0.782 ' CD2' HG21 ' A' ' 208' ' ' ILE . 22.7 m-85 -99.61 -30.36 12.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.855 0.36 . . . . 75.42 111.021 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 103.31 175.46 26.29 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.811 -0.709 . . . . 70.34 112.67 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 7.9 ttmt -57.6 -40.05 78.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.881 0.372 . . . . 74.32 110.848 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -44.6 96.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.059 -0.519 . . . . 70.22 110.607 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 109.14 -154.31 16.53 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.851 -0.69 . . . . 70.32 112.487 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.444 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.6 OUTLIER -139.82 87.3 12.91 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.718 0.294 . . . . 63.13 110.703 179.932 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.11 -22.12 67.64 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.54 2.16 . . . . 74.25 112.471 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.61 -42.11 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.882 0.372 . . . . 72.35 110.866 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -109.79 23.32 14.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.112 -0.494 . . . . 72.12 111.401 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt 56.36 54.4 7.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 61.24 111.067 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 1.019 HD12 HD21 ' A' ' 139' ' ' LEU . 20.2 mm -110.57 111.71 57.0 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 74.33 111.055 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.08 161.05 7.14 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.43 2.086 . . . . 50.32 112.342 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.18 129.35 15.97 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.594 2.196 . . . . 75.24 112.313 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 67.86 37.09 3.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.335 -0.393 . . . . 73.4 110.918 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -91.75 157.45 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.256 -0.429 . . . . 72.21 111.326 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.5 155.97 18.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 62.13 110.507 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.654 HD11 ' CD2' ' A' ' 198' ' ' TYR . 32.4 mt -136.21 109.26 7.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.905 0.383 . . . . 75.54 111.314 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.87 HG23 ' HG2' ' A' ' 191' ' ' GLU . 38.6 m -109.71 137.04 48.09 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.075 -0.511 . . . . 42.24 110.941 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.614 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 13.7 p90 -153.6 178.02 10.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 61.54 111.039 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 217' ' ' GLU . . . . . 0.457 ' OE2' HD21 ' A' ' 116' ' ' LEU . 10.9 mt-10 -134.07 137.64 44.77 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.926 -0.579 . . . . 70.12 110.541 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.61 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.3 t -120.75 150.97 23.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.131 0.491 . . . . 74.13 111.976 -178.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -136.72 107.58 6.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.612 -0.722 . . . . 75.31 109.953 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.555 HD21 ' CG1' ' A' ' 223' ' ' ILE . 1.0 OUTLIER -70.84 130.57 42.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.433 -0.349 . . . . 70.21 110.913 -179.672 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 25.3 t -107.35 -31.47 2.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.351 -0.386 . . . . 72.21 111.465 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -169.56 160.58 9.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.884 0.373 . . . . 73.1 111.235 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.714 HG23 HG12 ' A' ' 131' ' ' VAL . 44.7 mt -140.56 110.02 3.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.111 -0.495 . . . . 54.24 111.028 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 224' ' ' ASP . . . . . 0.557 ' C ' HG12 ' A' ' 130' ' ' VAL . 2.4 m-20 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 61.13 110.911 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.979 HG11 HG21 ' A' ' 136' ' ' THR . 39.2 t . . . . . 0 CA--C 1.528 0.114 0 CA-C-O 120.705 0.288 . . . . 71.32 110.965 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.454 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 73.7 Cg_endo -76.48 136.44 17.5 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.654 2.236 . . . . 75.53 112.382 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.528 ' CD ' HD11 ' A' ' 149' ' ' ILE . 2.3 tp-100 -80.66 152.91 28.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.453 . . . . 74.14 110.867 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.7 114.55 1.18 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 72.44 111.173 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -87.75 -38.49 15.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.092 -0.503 . . . . 72.14 110.843 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.595 ' CE2' HD11 ' A' ' 20' ' ' LEU . 1.7 m-90 -112.79 173.69 6.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.955 -0.566 . . . . 63.35 110.708 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.407 ' HB ' ' NE2' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -115.09 150.86 35.3 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.063 -0.517 . . . . 75.05 110.69 179.93 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.476 HG12 ' HD2' ' A' ' 16' ' ' ARG . 39.2 t -56.04 -32.81 34.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.012 0.434 . . . . 72.14 110.668 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -75.62 -24.68 56.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.803 -0.635 . . . . 74.21 110.969 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.407 ' NE2' ' HB ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -82.04 -57.46 3.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.85 0.357 . . . . 70.24 110.803 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.515 ' CB ' HG22 ' A' ' 60' ' ' VAL . 0.9 OUTLIER -49.66 -63.41 1.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.28 -0.418 . . . . 70.03 110.952 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.581 ' CG ' HG21 ' A' ' 60' ' ' VAL . 24.4 mtp180 -53.84 -24.38 15.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 61.45 111.194 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.9 177.46 0.15 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.009 0.433 . . . . 74.14 111.255 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.38 17.08 21.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.826 -0.625 . . . . 62.44 111.151 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -106.83 -24.76 11.96 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.527 -0.306 . . . . 64.51 111.263 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.614 HD22 HD11 ' A' ' 25' ' ' ILE . 6.3 tt -93.98 117.8 67.21 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.517 -0.31 . . . . 72.31 111.051 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.42 ' N ' HD23 ' A' ' 20' ' ' LEU . 31.5 Cg_exo -59.07 127.2 23.35 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.419 2.079 . . . . 73.53 112.076 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -24.13 67.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 74.52 111.162 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HA ' HD12 ' A' ' 26' ' ' ILE . 15.4 ptpt -53.91 -39.73 66.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.343 -0.389 . . . . 63.41 111.523 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -73.74 -55.09 6.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.896 0.379 . . . . 70.33 111.015 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.622 ' O ' HD12 ' A' ' 29' ' ' LEU . 28.7 mt -44.71 -33.65 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.862 -0.608 . . . . 64.23 111.379 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.741 HG12 HD21 ' A' ' 59' ' ' LEU . 6.8 mt -76.02 -39.87 37.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 74.3 110.868 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.2 mtpt -72.15 -26.15 61.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.976 -0.556 . . . . 72.2 111.044 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.486 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 33.8 t80 -69.57 -44.63 70.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.05 0.452 . . . . 75.12 110.742 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.691 HD21 ' HA ' ' A' ' 63' ' ' TYR . 2.9 mt -71.7 -24.39 61.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.705 -0.68 . . . . 65.3 110.992 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -76.38 -24.11 54.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.298 -0.41 . . . . 73.24 110.703 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -103.39 -10.19 18.82 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.253 -0.43 . . . . 73.51 111.125 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.486 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 12.1 m170 -116.58 -11.2 11.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.405 -0.361 . . . . 72.54 111.324 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -121.06 165.27 14.15 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.708 -0.758 . . . . 55.2 112.42 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -92.6 150.88 20.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.606 0.241 . . . . 74.25 110.515 179.739 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.562 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.2 p-10 -48.9 -57.08 7.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.758 0.313 . . . . 61.52 110.941 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.5 m -47.94 -51.97 21.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.018 0.437 . . . . 54.15 110.736 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.493 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 12.5 t80 -52.94 -47.4 68.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.745 -0.662 . . . . 74.22 110.277 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.519 HD22 ' HB3' ' A' ' 43' ' ' LEU . 14.1 mt -65.36 -40.69 93.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.915 -0.584 . . . . 74.42 110.674 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.833 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -49.59 -43.25 46.2 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.227 -0.442 . . . . 54.11 111.063 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -58.01 -29.32 65.2 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.868 -0.606 . . . . 72.13 110.74 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 -112.82 12.02 19.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 55.32 111.102 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 54.44 37.45 27.76 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.866 0.365 . . . . 71.01 110.748 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.679 HD21 HD23 ' A' ' 59' ' ' LEU . 15.3 mt -94.37 -20.95 19.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 74.34 111.895 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.833 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -78.15 155.53 30.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.099 0.476 . . . . 75.25 111.153 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.92 -124.67 6.1 Favored Glycine 0 N--CA 1.451 -0.302 0 CA-C-N 115.638 -0.71 . . . . 64.55 112.43 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.757 ' O ' HG23 ' A' ' 50' ' ' VAL . 8.0 m120 -116.4 119.31 35.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.796 0.331 . . . . 64.41 110.969 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.708 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -45.69 -52.56 2.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.17 -0.468 . . . . 74.03 111.4 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -47.7 -37.09 12.34 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.909 -0.587 . . . . 74.22 110.842 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -85.58 -26.6 26.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.866 -0.606 . . . . 73.21 110.931 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.757 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.5 t -78.59 -26.06 13.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.238 -0.437 . . . . 64.5 111.345 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.33 -25.39 67.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.428 -0.351 . . . . 63.44 111.103 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -95.17 -27.62 15.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 71.31 110.803 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -100.32 33.84 2.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.486 . . . . 74.4 111.012 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -166.76 135.57 2.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 72.21 110.984 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.401 ' H ' ' HB2' ' A' ' 58' ' ' HIS . 14.7 p30 -94.63 177.7 5.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.271 -0.422 . . . . 72.21 110.974 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.558 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -56.62 -57.82 10.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.315 -0.402 . . . . 74.33 110.929 -179.883 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.54 -26.94 64.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.057 -0.519 . . . . 64.04 110.602 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.401 ' HB2' ' H ' ' A' ' 55' ' ' ASN . 0.1 OUTLIER -63.01 -45.69 91.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.023 -0.535 . . . . 75.13 110.793 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.741 HD21 HG12 ' A' ' 26' ' ' ILE . 23.9 mt -73.82 -29.03 61.92 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.714 -0.675 . . . . 75.43 111.202 -179.772 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.581 HG21 ' CG ' ' A' ' 16' ' ' ARG . 21.1 t -81.08 -43.98 20.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.901 0.382 . . . . 71.32 111.057 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.0 m -59.95 -33.14 71.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.971 -0.559 . . . . 71.43 110.695 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.436 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -84.46 -23.12 30.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 72.52 111.129 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.691 ' HA ' HD21 ' A' ' 29' ' ' LEU . 82.2 t80 -83.78 -23.03 31.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.257 -0.429 . . . . 71.3 110.981 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.502 ' ND2' HG12 ' A' ' 60' ' ' VAL . 42.9 m-20 -81.79 -55.07 4.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 75.23 111.419 -179.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.493 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 4.2 p-80 -61.65 -29.8 70.3 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.153 -0.476 . . . . 71.23 111.296 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.715 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.1 tt -50.2 -40.01 45.88 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.891 0.377 . . . . 64.32 111.194 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -79.03 -38.75 35.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.52 . . . . 74.41 110.695 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.45 -41.15 93.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.941 -0.572 . . . . 75.14 110.768 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.2 p -92.64 -2.61 55.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.936 -0.574 . . . . 60.3 111.462 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.13 38.77 10.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.768 0.318 . . . . 73.22 111.353 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.444 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 45.3 mtt-85 -93.13 43.68 1.13 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.308 -0.406 . . . . 72.14 110.992 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.529 ' HA ' HD21 ' A' ' 66' ' ' LEU . 89.8 m-85 -64.5 178.71 0.7 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 75.43 110.826 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.4 ttmm . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.28 -0.418 . . . . 74.2 110.923 179.988 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.448 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.794 0.331 . . . . 64.23 111.018 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 20.3 p90 -157.83 161.93 38.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.299 -0.409 . . . . 74.52 110.84 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 12.2 m -131.46 103.49 6.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 64.13 111.043 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.66 ' HD2' ' HB1' ' A' ' 178' ' ' ALA . 13.8 tttm -109.59 151.49 26.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 74.24 110.705 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.459 ' O ' HD12 ' A' ' 116' ' ' LEU . 2.1 m -143.31 128.47 18.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 61.43 110.874 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.607 ' O ' HG13 ' A' ' 115' ' ' VAL . 9.2 p -78.55 106.34 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.247 -0.433 . . . . 75.35 111.14 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.459 HD12 ' O ' ' A' ' 114' ' ' SER . 6.8 mp -78.94 -78.01 0.16 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.208 -0.451 . . . . 74.23 110.79 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -86.73 108.07 18.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 73.4 110.753 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.44 121.88 12.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.47 . . . . 70.5 111.049 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -100.03 -159.52 28.41 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.74 -0.743 . . . . 71.35 112.139 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.416 ' O ' ' HB2' ' A' ' 121' ' ' LYS . 0.5 OUTLIER -36.11 -48.87 0.63 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.876 0.369 . . . . 73.02 111.572 -179.479 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 120' ' ' ASP . 20.6 mtpt 67.58 36.9 3.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.845 -0.616 . . . . 54.32 110.349 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -153.91 -44.91 0.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.758 -0.656 . . . . 64.05 110.676 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -88.86 98.47 11.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.14 -0.482 . . . . 74.12 110.853 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -110.61 146.19 33.85 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 65.15 110.842 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.617 ' CB ' HG11 ' A' ' 166' ' ' VAL . 51.7 Cg_exo -54.56 125.55 19.35 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.511 2.141 . . . . 63.44 112.453 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.99 152.22 20.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.109 -0.496 . . . . 74.51 110.8 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -55.22 111.59 0.89 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.243 -0.435 . . . . 62.34 110.881 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 99.8 -10.82 60.79 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.742 -0.742 . . . . 60.11 112.708 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -86.92 134.49 33.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.877 0.37 . . . . 70.31 110.953 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.545 HG22 ' N ' ' A' ' 131' ' ' VAL . 7.1 p -70.65 163.38 3.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 73.11 110.989 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.871 HG22 ' O ' ' A' ' 164' ' ' PHE . 15.7 m -155.05 146.55 13.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.241 -0.436 . . . . 74.24 111.017 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.463 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.89 117.91 22.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.735 0.302 . . . . 72.22 110.891 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.47 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 22.3 p -152.48 166.63 31.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 73.43 111.13 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.57 ' HB3' HD13 ' A' ' 149' ' ' ILE . 19.1 m95 -101.92 164.22 11.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.056 -0.52 . . . . 73.23 110.239 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.401 ' CD1' ' OD1' ' A' ' 148' ' ' ASN . 28.6 p90 -160.38 135.16 7.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.072 0.463 . . . . 75.04 111.867 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.979 HG21 HG11 ' A' ' 5' ' ' VAL . 2.9 m -124.74 109.52 13.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.707 -0.679 . . . . 74.41 110.248 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.67 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.55 144.98 17.55 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.613 -0.803 . . . . 51.4 113.414 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.785 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.79 149.51 29.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.863 0.363 . . . . 33.42 110.825 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.81 HD21 HD12 ' A' ' 208' ' ' ILE . 22.7 mt -88.05 -176.37 5.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 72.21 110.845 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -55.87 -43.58 77.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.356 -0.383 . . . . 73.03 110.899 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.07 -16.78 54.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.945 -0.57 . . . . 73.32 111.161 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 107.31 25.86 5.91 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.724 -0.751 . . . . 32.54 112.589 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.5 m -82.06 112.72 19.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.776 0.322 . . . . 73.42 110.867 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.9 t -66.41 126.78 26.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 62.54 111.171 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.689 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 38.7 p90 -114.36 -28.29 7.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.223 -0.444 . . . . 72.2 111.171 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 146' ' ' ASP . . . . . 0.421 ' HB2' ' CE1' ' A' ' 145' ' ' PHE . 51.6 m-20 -156.24 111.43 2.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.384 -0.371 . . . . 71.14 110.888 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.633 HG23 HG23 ' A' ' 136' ' ' THR . 61.6 m -142.84 108.88 5.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 25.02 111.096 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.401 ' OD1' ' CD1' ' A' ' 135' ' ' TYR . 20.0 p-10 -102.76 25.6 9.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.428 . . . . 71.03 110.909 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.57 HD13 ' HB3' ' A' ' 134' ' ' TRP . 9.0 mm . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.342 -0.39 . . . . 71.22 110.83 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.1 0 CA-C-O 120.809 0.338 . . . . 74.53 111.097 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 15.4 mttp -146.4 147.7 31.82 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.901 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.95 158.2 57.51 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.6 2.2 . . . . 73.22 112.301 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 1.6 tt -76.43 123.6 26.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 64.13 110.451 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.632 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.3 122.35 42.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.951 0.405 . . . . 64.35 111.411 -179.851 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.871 ' O ' HG22 ' A' ' 131' ' ' VAL . 6.5 p90 -150.98 143.41 24.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 75.04 110.508 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.63 ' O ' HG12 ' A' ' 168' ' ' VAL . 7.3 mtmt -82.25 141.64 32.79 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.079 0.466 . . . . 74.14 111.226 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.617 HG11 ' CB ' ' A' ' 125' ' ' PRO . 33.4 m -87.57 149.15 4.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.779 -0.646 . . . . 63.52 111.167 -179.468 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.74 24.8 75.43 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.857 -0.687 . . . . 51.52 112.456 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.693 HG22 ' O ' ' A' ' 168' ' ' VAL . 8.4 p -131.69 40.93 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.846 0.355 . . . . 73.35 111.103 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 40.6 34.18 0.68 Allowed Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.996 -0.621 . . . . 51.12 112.942 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.24 -34.26 32.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.053 0.454 . . . . 64.43 110.411 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.8 m -127.34 179.72 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.799 -0.637 . . . . 72.03 110.83 179.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.596 ' CD1' HD13 ' A' ' 192' ' ' ILE . 4.1 pt -58.72 163.84 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.442 -0.344 . . . . 70.04 111.091 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -71.13 -29.21 64.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 65.02 111.197 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.12 -38.09 41.06 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.671 -0.776 . . . . 73.43 112.279 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.734 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.2 t90 -75.22 -32.65 61.21 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.851 0.357 . . . . 75.52 110.996 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -61.94 -43.95 97.79 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 62.53 110.524 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -68.35 -30.82 69.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.903 -0.59 . . . . 73.1 110.751 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.737 ' O ' HG22 ' A' ' 181' ' ' THR . . . -78.0 -61.97 1.83 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.202 -0.454 . . . . 65.23 111.379 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.704 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 6.7 mt -56.07 -31.71 63.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.043 -0.526 . . . . 75.33 111.102 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 35.0 tp -59.49 -32.63 70.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.375 -0.375 . . . . 74.22 111.036 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 181' ' ' THR . . . . . 0.737 HG22 ' O ' ' A' ' 178' ' ' ALA . 12.8 t -92.75 -0.65 57.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.327 -0.397 . . . . 74.13 111.479 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.481 ' HE3' ' C ' ' A' ' 218' ' ' VAL . 0.0 OUTLIER -73.26 152.12 41.13 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.698 0.285 . . . . 62.0 110.871 179.905 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.48 162.61 15.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.296 -0.411 . . . . 74.3 111.107 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 184' ' ' LYS . . . . . 0.635 ' HA ' HD22 ' A' ' 220' ' ' LEU . 1.2 tttm -61.38 119.42 8.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.924 -0.58 . . . . 53.33 111.144 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 76.03 17.79 79.82 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.99 -0.624 . . . . 71.44 113.042 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 186' ' ' GLU . . . . . 0.538 ' CD ' HG23 ' A' ' 115' ' ' VAL . 1.1 tt0 -96.72 145.99 25.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.873 0.368 . . . . 71.41 111.105 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt -117.33 136.88 52.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 62.2 110.01 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -149.77 176.12 10.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.033 0.444 . . . . 53.55 111.808 -179.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.11 136.27 36.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.691 -0.686 . . . . 63.03 109.572 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.71 HD21 ' CE1' ' A' ' 216' ' ' PHE . 1.4 pt? -140.25 140.42 35.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.141 0.496 . . . . 62.32 112.217 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.739 ' HB3' HG23 ' A' ' 215' ' ' THR . 0.0 OUTLIER -117.74 106.02 12.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.609 -0.723 . . . . 53.14 110.034 179.113 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.596 HD13 ' CD1' ' A' ' 172' ' ' ILE . 4.2 mt -96.52 148.36 5.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.999 0.428 . . . . 60.12 111.582 -179.226 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.425 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.6 OUTLIER -81.69 167.51 30.76 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.765 -0.652 . . . . 65.4 110.477 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 194' ' ' PRO . . . . . 0.425 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 18.1 Cg_endo -60.1 -39.84 66.05 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.462 2.108 . . . . 64.13 112.222 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.12 -22.72 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.172 -0.467 . . . . 65.02 111.449 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.448 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 8.9 m0 -118.03 37.01 4.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.687 0.28 . . . . 72.32 111.399 -179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -155.43 -84.56 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.414 -0.357 . . . . 74.01 111.362 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 198' ' ' TYR . . . . . 0.459 ' HD2' HG21 ' A' ' 208' ' ' ILE . 41.4 m-85 -106.0 -27.95 10.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.905 0.384 . . . . 75.21 110.828 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 107.28 178.9 22.55 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.846 -0.692 . . . . 71.33 112.836 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -59.61 -36.22 75.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.826 0.346 . . . . 74.44 110.892 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.6 -50.03 75.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 64.12 110.658 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.3 -153.38 17.25 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.86 -0.686 . . . . 70.05 112.595 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.446 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 2.0 tm0? -152.15 84.26 4.9 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.837 0.351 . . . . 72.51 110.515 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -49.99 -44.43 37.34 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.762 2.308 . . . . 72.31 112.783 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.72 -42.12 71.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 65.24 111.012 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.689 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -96.43 27.37 3.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.031 -0.531 . . . . 61.24 111.29 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt 49.19 30.65 3.15 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.889 0.376 . . . . 61.33 111.057 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.81 HD12 HD21 ' A' ' 139' ' ' LEU . 20.8 mm -94.8 111.75 55.49 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.098 -0.501 . . . . 73.14 111.188 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 209' ' ' PRO . . . . . 0.561 ' HG2' ' HB2' ' A' ' 212' ' ' ALA . 55.9 Cg_endo -69.95 171.04 15.4 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.405 2.07 . . . . 54.14 112.201 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.79 120.95 8.33 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.512 2.141 . . . . 74.24 112.228 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 211' ' ' ASN . . . . . 0.405 ' HA ' ' HG3' ' A' ' 194' ' ' PRO . 49.2 m-80 63.4 70.38 0.53 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.173 -0.467 . . . . 72.24 110.859 -179.722 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 212' ' ' ALA . . . . . 0.561 ' HB2' ' HG2' ' A' ' 209' ' ' PRO . . . -122.42 154.7 37.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.183 -0.462 . . . . 72.42 111.336 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 213' ' ' LYS . . . . . 0.723 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.0 OUTLIER -90.42 149.43 22.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.019 -0.537 . . . . 71.23 110.448 179.646 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.723 HD23 ' O ' ' A' ' 213' ' ' LYS . 9.0 mt -131.5 109.72 10.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.857 0.361 . . . . 75.22 111.313 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.739 HG23 ' HB3' ' A' ' 191' ' ' GLU . 1.4 m -110.11 140.49 44.13 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.057 -0.519 . . . . 74.21 110.779 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.71 ' CE1' HD21 ' A' ' 190' ' ' LEU . 23.2 p90 -155.92 -179.67 8.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.077 0.465 . . . . 75.14 111.374 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 217' ' ' GLU . . . . . 0.417 ' HB3' ' HB2' ' A' ' 7' ' ' GLN . 4.1 mt-10 -132.89 136.61 46.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.72 -0.673 . . . . 73.15 110.256 179.41 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.734 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.8 t -120.99 150.31 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.018 0.437 . . . . 74.14 111.792 -178.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -136.23 108.51 7.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.809 -0.632 . . . . 71.24 110.27 179.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.696 HD21 HG13 ' A' ' 223' ' ' ILE . 2.2 tt -70.05 129.55 39.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.332 -0.394 . . . . 64.1 110.91 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 29.6 t -105.99 -31.7 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.169 -0.469 . . . . 74.25 111.483 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 222' ' ' ASP . . . . . 0.414 ' N ' HD23 ' A' ' 220' ' ' LEU . 5.4 t70 -170.3 161.14 8.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.93 0.395 . . . . 74.31 111.219 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.821 HG23 HG12 ' A' ' 131' ' ' VAL . 38.4 mt -140.85 110.21 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.053 -0.521 . . . . 65.31 111.003 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 224' ' ' ASP . . . . . 0.525 ' C ' HG12 ' A' ' 130' ' ' VAL . 2.7 m-20 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 63.33 110.875 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.934 HG11 HG21 ' A' ' 136' ' ' THR . 31.4 t . . . . . 0 CA--C 1.529 0.159 0 CA-C-O 120.577 0.227 . . . . 42.24 110.94 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -82.9 153.64 14.86 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.637 2.224 . . . . 55.52 112.607 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.459 ' NE2' ' O ' ' A' ' 217' ' ' GLU . 1.7 tp-100 -86.38 152.84 22.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 65.02 110.825 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.75 127.03 28.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 54.45 111.134 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -95.58 -31.43 13.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 54.31 110.892 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.455 ' CD1' HD11 ' A' ' 20' ' ' LEU . 3.0 m-90 -114.23 173.62 6.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.046 -0.525 . . . . 74.12 110.732 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 m -115.55 152.3 33.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.044 -0.526 . . . . 53.22 110.708 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.427 ' CG1' ' HD2' ' A' ' 16' ' ' ARG . 49.1 t -56.24 -34.01 38.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 62.1 110.691 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -73.34 -25.28 60.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.968 -0.56 . . . . 74.44 111.147 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -82.01 -56.55 3.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.821 0.343 . . . . 54.15 110.942 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.687 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.3 mt -49.49 -64.64 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 73.41 111.17 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.502 ' HG3' HG11 ' A' ' 60' ' ' VAL . 34.6 mtp85 -54.11 -25.0 19.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 64.03 111.229 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.96 176.62 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.0 0.429 . . . . 71.53 111.293 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -110.34 17.01 21.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.878 -0.601 . . . . 74.24 111.175 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -112.7 -23.45 10.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.554 -0.294 . . . . 73.32 111.222 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.717 HD22 HD11 ' A' ' 25' ' ' ILE . 10.2 tt -90.07 114.03 59.38 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.509 -0.314 . . . . 71.31 110.99 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -57.92 125.3 18.18 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.493 2.129 . . . . 63.11 112.303 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -24.19 67.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 71.23 111.245 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.499 ' HA ' HD12 ' A' ' 26' ' ' ILE . 29.5 mmtt -52.69 -35.16 54.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.397 . . . . 73.45 111.37 -179.732 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.91 -56.59 4.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.283 -0.417 . . . . 73.15 111.109 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.717 HD11 HD22 ' A' ' 20' ' ' LEU . 40.4 mt -44.79 -32.86 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.896 -0.593 . . . . 72.53 111.474 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.699 HG12 HD21 ' A' ' 59' ' ' LEU . 9.4 mt -75.19 -41.72 44.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.964 0.412 . . . . 45.12 110.907 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -71.55 -25.02 62.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.874 -0.603 . . . . 74.42 111.116 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -70.03 -44.71 68.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.042 0.448 . . . . 62.12 110.761 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.782 HD23 HD12 ' A' ' 66' ' ' LEU . 7.7 mt -72.17 -21.42 61.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.728 -0.669 . . . . 71.21 111.101 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -83.87 -25.78 29.98 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.356 -0.384 . . . . 72.25 111.066 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -100.97 -1.01 35.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.422 -0.354 . . . . 70.52 111.512 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.422 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.9 m-70 -131.95 -6.47 3.53 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.697 0.258 . . . . 61.1 111.697 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.87 164.43 13.07 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.735 -0.745 . . . . 22.0 112.357 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 54.5 p -91.53 147.94 22.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.584 0.23 . . . . 60.33 110.553 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.727 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -48.16 -57.03 6.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.798 0.332 . . . . 54.4 110.991 -179.77 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.9 m -48.67 -50.03 34.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.083 0.468 . . . . 74.51 110.574 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.479 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 36.5 t80 -53.6 -48.76 68.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.695 -0.684 . . . . 52.55 110.404 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.409 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 15.8 mt -65.01 -40.46 94.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.936 -0.575 . . . . 63.23 110.719 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.744 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.17 -47.68 23.89 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.046 0.45 . . . . 75.53 111.098 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -58.09 -26.14 62.2 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.72 -0.673 . . . . 64.4 110.842 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.445 ' O ' ' CG ' ' A' ' 42' ' ' LYS . 52.5 m-70 -112.4 10.57 19.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.265 -0.425 . . . . 74.1 111.239 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.445 ' CG ' ' O ' ' A' ' 41' ' ' HIS . 6.0 ptpt 49.18 35.28 7.08 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.954 0.406 . . . . 63.23 110.995 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.747 HD13 HD13 ' A' ' 29' ' ' LEU . 19.0 mt -93.51 -20.44 20.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.959 -0.564 . . . . 72.23 111.574 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.744 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -79.32 159.26 27.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.026 0.441 . . . . 71.23 111.147 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.56 -120.53 4.97 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 115.775 -0.648 . . . . 60.0 112.482 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.764 ' O ' HG23 ' A' ' 50' ' ' VAL . 46.6 m-80 -116.37 116.12 27.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.826 0.346 . . . . 74.21 110.878 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.662 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.83 -55.57 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.164 -0.471 . . . . 73.23 111.407 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.3 ptpt -46.95 -36.85 8.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.855 -0.611 . . . . 63.41 110.988 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -85.76 -25.47 26.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.939 -0.573 . . . . 72.22 111.067 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.764 HG23 ' O ' ' A' ' 46' ' ' ASN . 28.3 t -83.09 -25.92 7.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.365 -0.379 . . . . 74.01 111.403 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.11 -16.29 63.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.426 -0.352 . . . . 34.4 111.474 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.32 -34.3 12.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.808 0.337 . . . . 34.41 110.895 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.586 HG22 ' HA ' ' A' ' 50' ' ' VAL . 7.4 t -86.95 -30.14 21.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.199 -0.455 . . . . 51.23 111.038 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.13 126.64 40.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 33.1 111.142 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -82.0 177.04 9.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 65.01 110.683 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.574 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -58.84 -58.24 9.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.91 0.386 . . . . 75.44 110.541 179.912 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.17 -27.32 68.99 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.055 -0.52 . . . . 64.04 110.582 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.59 -40.61 95.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.067 -0.515 . . . . 70.41 110.399 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.699 HD21 HG12 ' A' ' 26' ' ' ILE . 20.3 mt -76.59 -31.12 57.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.743 -0.662 . . . . 73.33 110.936 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.687 HG22 ' HB3' ' A' ' 15' ' ' LEU . 21.7 t -77.75 -42.73 29.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.995 0.426 . . . . 73.1 110.68 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 53.6 m -60.51 -35.46 76.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.885 -0.598 . . . . 74.31 110.398 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.448 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -79.54 -22.06 44.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.981 -0.554 . . . . 61.4 110.823 179.456 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.682 ' HA ' HD21 ' A' ' 29' ' ' LEU . 20.4 t80 -83.69 -22.94 31.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.066 -0.516 . . . . 74.43 110.837 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.522 ' ND2' HG12 ' A' ' 60' ' ' VAL . 43.6 m-80 -85.73 -53.74 4.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.17 0.509 . . . . 73.4 110.809 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.479 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 1.6 p-80 -59.97 -24.14 64.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.86 -0.609 . . . . 72.02 110.788 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.782 HD12 HD23 ' A' ' 29' ' ' LEU . 0.6 OUTLIER -44.93 -45.99 10.74 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.016 0.436 . . . . 73.01 110.521 179.641 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -79.28 -38.61 34.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.566 -0.743 . . . . 74.31 109.929 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -64.18 -16.24 61.52 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.739 -0.664 . . . . 53.03 111.246 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.86 -11.99 10.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.349 -0.387 . . . . 71.22 111.269 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 51.91 34.63 13.94 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.832 0.348 . . . . 74.35 110.987 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.455 ' CB ' ' CD1' ' A' ' 37' ' ' PHE . 91.6 mtt180 -98.4 46.45 1.0 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 72.43 110.91 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.599 ' CZ ' HD22 ' A' ' 66' ' ' LEU . 82.1 m-85 -71.15 -178.59 2.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.077 -0.511 . . . . 75.54 110.784 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.8 tttp . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.303 -0.408 . . . . 72.4 110.824 179.922 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.2 mttt . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.864 0.364 . . . . 74.32 110.949 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -167.29 151.68 6.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 71.14 110.864 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 26.0 m -113.74 129.94 56.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 60.11 110.296 179.55 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.4 ' CG ' ' HB3' ' A' ' 190' ' ' LEU . 0.1 OUTLIER -129.93 144.14 51.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.973 0.416 . . . . 63.13 111.374 -179.546 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.428 ' O ' HD12 ' A' ' 116' ' ' LEU . 0.4 OUTLIER -139.94 120.86 14.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.919 -0.582 . . . . 61.25 110.461 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.604 ' O ' HG13 ' A' ' 115' ' ' VAL . 10.0 p -76.41 106.26 6.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.917 0.389 . . . . 41.32 111.191 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.455 HD11 ' HB3' ' A' ' 189' ' ' ARG . 6.6 mp -75.74 -75.38 0.18 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 70.41 110.87 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -96.97 107.94 20.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.154 -0.476 . . . . 62.23 110.9 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -58.68 126.29 27.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.166 -0.47 . . . . 73.32 110.937 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -86.26 -174.29 49.49 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.654 -0.784 . . . . 35.33 112.224 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -40.46 -40.95 1.32 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.828 0.347 . . . . 73.23 111.544 -179.477 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.8 tttp 73.4 43.15 0.38 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.461 . . . . 74.53 110.595 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.0 m -157.3 -45.41 0.07 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.899 -0.592 . . . . 73.31 110.55 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.14 97.55 10.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.07 -0.514 . . . . 71.01 110.692 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -111.11 156.12 41.47 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.078 -0.51 . . . . 74.31 110.834 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.776 ' HB2' HG21 ' A' ' 166' ' ' VAL . 46.9 Cg_endo -68.61 125.6 12.96 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.514 2.143 . . . . 71.14 112.342 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.98 152.16 20.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 73.24 110.937 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -58.84 116.1 3.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 72.51 110.9 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 105.05 -21.92 34.61 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.705 -0.759 . . . . 73.42 112.669 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.3 138.99 31.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.845 0.355 . . . . 74.41 110.828 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.701 HG12 ' HG3' ' A' ' 165' ' ' LYS . 24.4 m -69.59 171.95 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 72.12 111.235 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.896 HG22 ' O ' ' A' ' 164' ' ' PHE . 16.4 m -156.87 145.39 11.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.71 -0.677 . . . . 65.54 110.66 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.577 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -127.72 117.61 22.25 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.986 -0.285 . . . . 73.34 110.72 179.705 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.657 ' HB3' HD22 ' A' ' 220' ' ' LEU . 31.3 p -153.67 171.44 18.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.004 0.43 . . . . 70.03 111.15 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.51 ' HE1' HG21 ' A' ' 221' ' ' VAL . 10.0 m95 -107.67 161.85 14.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.8 -0.637 . . . . 75.33 110.107 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.489 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 45.1 p90 -161.74 137.19 7.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.07 0.462 . . . . 75.34 111.917 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.934 HG21 HG11 ' A' ' 5' ' ' VAL . 5.4 m -126.72 112.38 15.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.661 -0.699 . . . . 73.35 110.646 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.612 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.67 142.57 16.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.603 -0.808 . . . . 61.45 112.976 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.605 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -147.58 143.87 28.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.8 0.333 . . . . 71.42 110.762 179.79 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.456 HD23 ' HA ' ' A' ' 139' ' ' LEU . 14.2 mt -83.22 -177.63 6.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 73.44 110.977 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -59.29 -43.22 92.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 72.04 110.906 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.81 -7.78 54.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.045 -0.525 . . . . 74.24 111.327 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' GLY . . . . . 0.442 ' C ' HG22 ' A' ' 138' ' ' THR . . . 92.42 24.12 24.82 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.695 -0.764 . . . . 75.12 112.619 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.41 113.24 25.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.345 . . . . 52.23 110.777 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 137' ' ' GLY . 8.3 p -63.64 130.95 29.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 55.41 111.162 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.432 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 36.2 p90 -108.95 -28.2 9.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.001 -0.545 . . . . 73.12 110.842 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -168.19 122.23 0.92 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.176 -0.465 . . . . 72.11 110.768 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.549 ' OG1' HG23 ' A' ' 136' ' ' THR . 10.4 t -142.87 124.31 14.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.358 -0.383 . . . . 63.12 111.192 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.489 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 25.4 t-20 -91.86 40.85 1.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.082 -0.508 . . . . 60.54 110.804 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.437 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 6.7 mm . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.123 -0.489 . . . . 60.44 110.928 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.769 0.319 . . . . 65.13 111.097 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -146.38 134.38 10.6 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.255 -0.43 . . . . 73.23 110.837 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 161' ' ' PRO . . . . . 0.404 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 49.6 Cg_exo -55.37 156.4 17.41 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.446 2.097 . . . . 61.43 112.33 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.535 HD23 ' C ' ' A' ' 162' ' ' LEU . 4.0 tt -74.67 122.96 24.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 74.42 110.429 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.661 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -100.26 121.2 41.09 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.03 0.443 . . . . 74.21 111.48 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.896 ' O ' HG22 ' A' ' 131' ' ' VAL . 7.3 p90 -149.71 140.97 23.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.88 -0.6 . . . . 75.22 110.571 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.701 ' HG3' HG12 ' A' ' 130' ' ' VAL . 72.3 mttt -77.48 136.7 38.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.038 0.447 . . . . 64.44 111.111 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.776 HG21 ' HB2' ' A' ' 125' ' ' PRO . 35.1 m -87.65 149.31 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.822 -0.627 . . . . 54.01 111.084 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.87 22.83 78.34 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.786 -0.721 . . . . 75.53 112.565 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.671 HG23 ' HG2' ' A' ' 170' ' ' LYS . 28.9 m -131.06 42.18 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.88 0.371 . . . . 73.43 111.044 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.25 38.57 6.6 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 121.137 -0.554 . . . . 55.44 113.062 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 170' ' ' LYS . . . . . 0.671 ' HG2' HG23 ' A' ' 168' ' ' VAL . 0.6 OUTLIER -84.34 -47.03 11.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.933 0.397 . . . . 72.0 110.852 179.928 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.9 m -116.91 -179.94 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.943 -0.571 . . . . 62.22 110.913 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.554 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.88 161.44 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.414 -0.357 . . . . 74.42 111.297 -179.75 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 15.8 ttt85 -69.57 -26.68 64.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.195 -0.457 . . . . 73.13 110.998 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.11 -37.86 36.51 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.772 -0.727 . . . . 64.43 112.029 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.554 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 1.8 t90 -77.46 -32.9 54.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.024 0.44 . . . . 74.33 111.056 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 176' ' ' ASP . . . . . 0.639 ' O ' HD13 ' A' ' 180' ' ' LEU . 1.4 m-20 -65.63 -35.47 80.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.802 -0.635 . . . . 73.43 110.479 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -75.97 -29.17 58.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 71.01 110.634 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.582 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -81.92 -54.44 5.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 64.41 111.125 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.574 HD21 HG21 ' A' ' 218' ' ' VAL . 14.5 mt -62.26 -18.92 62.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.883 -0.599 . . . . 75.54 111.186 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.639 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.8 tp -56.46 -23.91 42.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.344 -0.389 . . . . 65.44 111.452 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 16.5 p -112.94 18.13 18.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.596 -0.275 . . . . 71.15 111.585 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.437 ' HG3' HD22 ' A' ' 179' ' ' LEU . 7.4 mmm -77.06 95.18 4.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.831 0.348 . . . . 63.23 111.123 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.3 168.18 7.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 73.12 111.064 -179.699 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -62.81 113.23 2.92 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.873 -0.603 . . . . 62.31 110.949 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 84.98 0.96 88.99 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 120.854 -0.689 . . . . 54.22 112.91 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.58 137.94 44.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.923 0.392 . . . . 74.44 111.503 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.75 137.41 53.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.976 -0.556 . . . . 71.44 109.766 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -141.83 168.59 19.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.259 0.552 . . . . 70.12 112.132 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 189' ' ' ARG . . . . . 0.455 ' HB3' HD11 ' A' ' 116' ' ' LEU . 1.4 tmt_? -137.78 101.01 4.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.391 -0.822 . . . . 63.15 109.766 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.582 HD13 ' CB ' ' A' ' 178' ' ' ALA . 0.8 OUTLIER -123.66 149.48 45.39 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.067 0.461 . . . . 71.1 112.011 -178.912 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.638 ' HB3' HG23 ' A' ' 215' ' ' THR . 0.2 OUTLIER -119.37 117.1 27.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.605 -0.725 . . . . 71.12 110.247 179.337 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.633 HD12 ' N ' ' A' ' 192' ' ' ILE . 3.3 mp -98.33 137.85 24.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.969 0.414 . . . . 71.03 111.516 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.41 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.4 mt-10 -71.36 167.56 28.94 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.866 -0.607 . . . . 75.4 110.499 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 194' ' ' PRO . . . . . 0.41 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 20.8 Cg_endo -60.94 -41.65 43.21 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.391 2.061 . . . . 65.21 112.261 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -53.11 -26.82 17.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 65.23 111.405 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 196' ' ' TRP . . . . . . . . . . . . . 17.8 m0 -116.1 37.01 3.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.494 -0.321 . . . . 65.23 111.178 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -157.84 -82.3 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.348 -0.387 . . . . 64.24 111.641 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 198' ' ' TYR . . . . . 0.586 ' CE2' HD13 ' A' ' 208' ' ' ILE . 14.2 m-85 -106.25 -32.9 7.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.907 0.384 . . . . 75.23 110.949 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 106.49 172.55 23.02 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.84 -0.695 . . . . 72.45 112.715 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 33.7 mtmt -61.59 -30.41 70.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.832 0.348 . . . . 73.14 110.902 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -56.16 -52.25 65.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 72.33 110.8 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 109.25 158.33 18.26 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.818 -0.706 . . . . 73.11 112.444 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.747 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.9 OUTLIER -104.76 84.84 1.04 Allowed Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 120.771 0.32 . . . . 64.11 110.758 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.01 -20.15 57.43 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.591 2.194 . . . . 52.4 112.412 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -58.56 -41.89 86.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.368 -0.378 . . . . 45.53 110.891 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.5 28.38 8.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.102 -0.499 . . . . 75.33 111.26 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 7.9 tttt 58.43 54.42 5.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.937 0.399 . . . . 70.24 110.95 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.747 HD12 ' HB3' ' A' ' 203' ' ' GLN . 33.9 mt -115.69 111.77 43.41 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 72.45 111.086 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.1 169.26 2.92 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.568 2.179 . . . . 71.11 112.398 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.27 128.01 12.49 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.636 2.224 . . . . 74.42 112.24 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 65.81 74.22 0.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.31 -0.404 . . . . 51.22 110.758 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.57 153.5 43.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.434 . . . . 74.01 111.365 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.12 139.16 30.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.011 -0.54 . . . . 75.22 110.367 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.447 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 5.8 mt -120.45 109.48 15.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.922 0.391 . . . . 73.1 111.441 -179.54 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.638 HG23 ' HB3' ' A' ' 191' ' ' GLU . 2.6 m -107.48 141.1 39.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.018 -0.537 . . . . 75.32 110.662 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.612 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 5.8 p90 -159.64 -177.7 6.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 73.43 111.177 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 217' ' ' GLU . . . . . 0.459 ' O ' ' NE2' ' A' ' 7' ' ' GLN . 17.9 mt-10 -138.71 141.86 38.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.899 -0.591 . . . . 72.33 110.552 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.574 HG21 HD21 ' A' ' 179' ' ' LEU . 23.5 t -121.55 152.43 25.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 70.42 112.01 -178.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -135.5 106.0 6.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.707 -0.679 . . . . 75.02 110.356 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.657 HD22 ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.67 126.79 30.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.362 -0.381 . . . . 73.43 110.658 -179.774 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.51 HG21 ' HE1' ' A' ' 134' ' ' TRP . 21.2 t -108.06 -30.25 2.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.263 -0.426 . . . . 71.13 111.654 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -169.96 160.05 8.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.915 0.388 . . . . 63.53 111.183 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.647 HG23 HG12 ' A' ' 131' ' ' VAL . 3.5 mp -141.85 111.27 2.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.971 -0.559 . . . . 61.21 110.955 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.327 -0.397 . . . . 64.44 110.958 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 1.021 HG11 HG21 ' A' ' 136' ' ' THR . 43.8 t . . . . . 0 CA--C 1.528 0.121 0 CA-C-O 120.62 0.248 . . . . 51.33 110.966 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.434 ' HG3' ' CG ' ' A' ' 32' ' ' HIS . 72.4 Cg_endo -77.62 136.99 15.89 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.638 2.226 . . . . 74.44 112.435 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.496 ' NE2' ' HB2' ' A' ' 134' ' ' TRP . 9.3 mm100 -80.25 155.52 27.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 71.14 110.902 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.09 112.81 0.78 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.137 -0.483 . . . . 64.13 111.221 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.449 ' HB2' ' HE2' ' A' ' 187' ' ' LYS . . . -90.44 -14.78 32.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 71.43 111.414 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.595 ' CE2' HD11 ' A' ' 20' ' ' LEU . 1.3 m-90 -137.98 173.79 11.26 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.967 0.413 . . . . 74.3 110.814 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.2 m -115.43 149.83 37.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.988 -0.551 . . . . 63.43 110.713 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.591 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.9 t -56.09 -31.33 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.926 0.393 . . . . 73.12 110.712 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -76.02 -25.96 56.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.871 -0.604 . . . . 70.11 111.004 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -82.11 -57.92 3.18 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.834 0.349 . . . . 54.12 110.813 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.644 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.3 mt -49.57 -63.09 1.21 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.222 -0.445 . . . . 73.2 110.948 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.591 ' HD2' HG12 ' A' ' 12' ' ' VAL . 25.4 mtt180 -53.99 -23.79 14.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.071 -0.513 . . . . 74.51 111.243 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.18 176.76 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.964 0.412 . . . . 62.43 111.121 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -110.34 16.8 21.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.95 -0.568 . . . . 74.31 111.158 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.41 -26.09 12.09 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.512 -0.313 . . . . 71.31 111.144 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.699 HD22 HD11 ' A' ' 25' ' ' ILE . 6.3 tt -91.97 111.55 50.45 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.39 -0.368 . . . . 64.53 111.016 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.406 ' O ' HD23 ' A' ' 20' ' ' LEU . 48.2 Cg_exo -55.88 130.01 38.04 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.378 2.052 . . . . 51.14 112.184 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.42 ' O ' HD12 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -62.31 -24.09 67.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 75.23 111.127 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.5 mttt -49.78 -43.19 48.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.31 -0.404 . . . . 71.2 111.588 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -73.86 -54.79 7.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.936 0.398 . . . . 75.12 111.07 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.699 HD11 HD22 ' A' ' 20' ' ' LEU . 25.7 mt -45.36 -33.86 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.846 -0.615 . . . . 71.43 111.443 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.694 HG12 HD21 ' A' ' 59' ' ' LEU . 6.7 mt -76.79 -39.85 31.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.284 -0.416 . . . . 73.24 110.995 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.1 mttt -72.86 -25.61 61.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.036 -0.529 . . . . 61.15 111.009 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -69.74 -45.78 67.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.121 0.486 . . . . 74.14 110.719 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.723 HD21 ' HA ' ' A' ' 63' ' ' TYR . 2.6 mt -70.17 -25.58 63.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.608 -0.724 . . . . 62.14 111.115 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -74.38 -26.74 60.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.355 -0.384 . . . . 64.2 110.893 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.416 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 8.6 pt-20 -90.81 -39.05 12.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.346 -0.388 . . . . 73.23 110.706 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.434 ' CG ' ' HG3' ' A' ' 6' ' ' PRO . 35.8 m170 -98.54 16.63 21.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 64.1 110.964 179.674 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.61 153.32 23.02 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.829 -0.7 . . . . 62.42 112.571 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.57 154.47 19.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.651 0.263 . . . . 53.33 110.515 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.67 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.1 OUTLIER -49.14 -56.97 7.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.76 0.315 . . . . 74.42 111.1 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -48.18 -50.23 29.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.033 0.444 . . . . 54.42 110.896 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.545 ' CZ ' HD12 ' A' ' 66' ' ' LEU . 13.4 t80 -54.04 -47.73 71.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.795 -0.639 . . . . 72.11 110.493 179.593 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.441 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 13.3 mt -66.02 -41.39 91.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.062 -0.517 . . . . 65.01 110.777 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.827 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -48.07 -42.04 27.67 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.076 0.465 . . . . 73.4 110.827 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -49.55 -50.11 43.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.621 -0.718 . . . . 74.4 110.926 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -101.49 15.3 29.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.076 -0.511 . . . . 63.21 111.291 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 36.1 mttt 54.98 39.92 31.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.884 0.373 . . . . 73.53 111.05 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 43' ' ' LEU . 17.0 mt -89.53 -22.18 22.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 72.41 111.487 -179.67 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.827 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.42 156.01 28.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.106 0.479 . . . . 74.23 111.171 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.72 -120.98 4.87 Favored Glycine 0 N--CA 1.451 -0.301 0 CA-C-N 115.641 -0.709 . . . . 74.12 112.379 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.897 ' O ' HG23 ' A' ' 50' ' ' VAL . 5.2 m120 -116.39 115.2 25.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.771 0.32 . . . . 53.42 110.948 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.531 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -45.18 -58.37 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.186 -0.461 . . . . 62.42 111.397 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 mmtt -45.57 -36.96 5.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.782 -0.644 . . . . 74.35 111.049 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -85.77 -26.54 25.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.939 -0.573 . . . . 71.53 110.993 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 46' ' ' ASN . 19.3 t -80.83 -26.03 10.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 71.12 111.417 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.64 -15.7 63.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.364 -0.38 . . . . 62.31 111.394 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.3 mtpt -95.17 -35.16 11.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.411 -0.359 . . . . 63.44 110.931 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 m -86.03 -22.42 27.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.173 -0.467 . . . . 61.44 111.318 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -107.95 136.76 47.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.467 -0.333 . . . . 35.33 111.19 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -93.27 -178.02 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 65.3 110.768 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.546 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -59.71 -58.1 10.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.825 0.345 . . . . 72.31 110.981 -179.758 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.32 -27.3 65.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.119 -0.491 . . . . 72.35 110.67 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -45.48 93.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.007 -0.542 . . . . 71.14 110.702 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.694 HD21 HG12 ' A' ' 26' ' ' ILE . 23.6 mt -73.31 -30.49 63.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.625 -0.716 . . . . 70.55 111.415 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.644 HG22 ' HB3' ' A' ' 15' ' ' LEU . 16.0 t -80.51 -43.67 21.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.989 0.424 . . . . 71.3 110.853 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.1 m -58.44 -35.87 72.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.881 -0.6 . . . . 71.43 110.583 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.71 -21.84 34.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.084 -0.507 . . . . 71.24 111.031 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.723 ' HA ' HD21 ' A' ' 29' ' ' LEU . 49.3 t80 -83.28 -22.96 32.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.298 -0.41 . . . . 73.22 111.162 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.476 ' ND2' HG12 ' A' ' 60' ' ' VAL . 19.8 m-80 -83.07 -54.03 5.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.885 0.374 . . . . 74.13 111.43 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.433 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 4.4 p-80 -61.16 -34.08 74.45 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.495 . . . . 63.03 111.283 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.661 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.2 tt -46.42 -40.47 12.24 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.898 0.38 . . . . 73.11 111.201 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -78.98 -36.09 41.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.009 -0.541 . . . . 74.42 110.691 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.536 ' HG2' HG23 ' A' ' 69' ' ' THR . 2.2 pt-20 -67.25 -39.85 86.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.058 -0.519 . . . . 72.24 110.873 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.536 HG23 ' HG2' ' A' ' 68' ' ' GLU . 71.5 p -94.87 -3.1 49.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.025 -0.534 . . . . 33.34 111.434 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 48.96 39.66 15.1 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.757 0.313 . . . . 61.45 111.38 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -93.52 43.66 1.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.384 -0.371 . . . . 73.34 111.034 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.447 ' HA ' HD21 ' A' ' 66' ' ' LEU . 88.5 m-85 -66.26 177.09 1.54 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.317 -0.401 . . . . 61.4 110.82 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.2 tttt . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.262 -0.426 . . . . 74.53 110.985 179.922 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.444 ' HB3' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 120.82 0.343 . . . . 70.02 110.687 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -166.53 150.52 7.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 74.14 110.858 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' THR . . . . . 0.428 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 77.0 m -112.23 133.02 54.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.126 -0.488 . . . . 75.32 110.346 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.402 ' CE ' HG22 ' A' ' 115' ' ' VAL . 1.0 OUTLIER -130.88 148.32 52.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.953 0.406 . . . . 64.11 111.33 -179.607 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -149.6 121.75 8.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.934 -0.576 . . . . 53.21 110.742 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.402 HG22 ' CE ' ' A' ' 113' ' ' LYS . 21.5 t -78.86 110.24 14.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.326 -0.397 . . . . 75.22 111.224 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.526 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -81.69 -46.62 14.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 64.03 110.926 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -124.32 108.12 11.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.438 . . . . 74.34 111.054 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.6 ttpm? -59.57 141.89 53.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 74.41 110.865 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.504 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -112.86 -156.11 12.35 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.738 -0.744 . . . . 71.21 112.605 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -36.05 -51.72 0.74 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.96 0.409 . . . . 64.52 111.527 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 69.03 33.82 3.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.926 -0.579 . . . . 63.1 110.307 -179.692 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 54.8 m -152.4 -44.61 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.76 -0.655 . . . . 60.43 110.698 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -88.94 91.13 8.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.481 . . . . 62.13 110.732 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -99.5 152.72 37.9 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 74.15 110.826 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.57 ' HB2' HG21 ' A' ' 166' ' ' VAL . 61.2 Cg_endo -72.96 125.5 10.46 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.551 2.167 . . . . 72.24 112.495 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.4 mmtm -96.36 154.13 17.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.982 -0.554 . . . . 63.23 110.865 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.0 tptm -56.75 119.67 6.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.24 -0.437 . . . . 52.44 110.795 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 100.24 -22.72 38.81 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.626 -0.797 . . . . 72.44 112.366 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.708 ' O ' HG22 ' A' ' 166' ' ' VAL . 5.0 m-20 -81.54 137.63 35.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.745 0.307 . . . . 70.24 110.69 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.57 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 15.6 m -75.09 175.41 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.198 0.523 . . . . 65.43 111.767 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.685 HG12 HG23 ' A' ' 223' ' ' ILE . 22.3 m -157.75 147.0 9.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.342 -0.845 . . . . 74.13 110.557 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.638 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -125.21 117.27 23.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.701 0.286 . . . . 74.41 110.633 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.456 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 32.1 p -154.2 167.25 30.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.87 0.367 . . . . 74.33 111.156 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.602 ' HB3' HD11 ' A' ' 149' ' ' ILE . 62.6 m95 -99.66 160.6 14.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.972 -0.558 . . . . 64.25 110.065 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 33.4 p90 -158.76 135.18 9.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.065 0.459 . . . . 75.23 111.584 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' THR . . . . . 1.021 HG21 HG11 ' A' ' 5' ' ' VAL . 54.3 m -126.74 111.59 14.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.658 -0.701 . . . . 64.24 110.417 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.577 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.78 142.9 16.35 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.604 -0.808 . . . . 75.31 113.07 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.69 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.1 OUTLIER -149.34 138.95 21.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.761 0.315 . . . . 73.1 110.799 179.764 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.831 HD11 HG12 ' A' ' 208' ' ' ILE . 32.6 mt -72.81 -178.14 2.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.296 -0.411 . . . . 63.15 110.64 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -58.89 -42.59 89.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.987 0.422 . . . . 73.34 110.796 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.27 -7.67 55.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.942 -0.572 . . . . 72.44 111.368 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 94.7 25.77 14.61 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.648 -0.787 . . . . 63.02 112.582 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.27 108.38 18.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.8 0.333 . . . . 73.44 110.837 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 144' ' ' VAL . 11.2 p -66.31 124.01 20.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.18 -0.463 . . . . 75.53 111.116 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.434 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 44.8 p90 -110.08 -21.28 12.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.155 -0.475 . . . . 71.4 111.095 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -157.02 127.94 6.73 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.857 0.361 . . . . 74.22 110.997 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 75.1 m -142.79 105.28 4.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 54.1 110.862 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -76.07 -6.52 51.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 73.42 111.323 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.716 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.4 mp . . . . . 0 C--N 1.33 -0.263 0 CA-C-O 120.827 0.346 . . . . 63.42 111.0 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.779 0.323 . . . . 60.53 111.131 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.2 tttt -146.64 145.41 23.09 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 54.43 110.676 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.65 158.02 58.01 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.355 2.037 . . . . 73.33 112.239 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -80.04 127.87 32.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.126 -0.488 . . . . 72.12 110.845 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.638 ' HB3' ' CD2' ' A' ' 132' ' ' HIS . 0.8 OUTLIER -105.73 126.83 52.62 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.272 -0.422 . . . . 74.11 111.047 179.801 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.701 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 20.8 p90 -151.35 141.45 22.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 72.33 110.951 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.605 ' CB ' HG21 ' A' ' 168' ' ' VAL . 2.4 mtpt -69.62 130.81 43.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.305 -0.407 . . . . 71.33 110.909 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.708 HG22 ' O ' ' A' ' 129' ' ' ASP . 33.3 m -87.77 149.32 4.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 63.33 111.057 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 69.04 24.22 75.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.729 -0.748 . . . . 74.21 112.577 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.605 HG21 ' CB ' ' A' ' 165' ' ' LYS . 15.4 m -134.09 46.43 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.915 0.388 . . . . 73.1 111.125 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.29 36.24 2.92 Favored Glycine 0 C--N 1.331 0.302 0 CA-C-N 116.101 -0.499 . . . . 50.4 113.295 179.612 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 170' ' ' LYS . . . . . 0.513 ' HG2' HG23 ' A' ' 168' ' ' VAL . 0.3 OUTLIER -82.43 -45.72 14.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.858 0.361 . . . . 74.42 111.089 -179.867 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -119.26 -179.64 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.087 -0.506 . . . . 74.4 110.994 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.557 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -58.35 159.33 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.394 -0.367 . . . . 72.1 111.136 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 7.4 ttt85 -68.04 -27.23 66.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.254 -0.43 . . . . 73.13 111.191 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.3 -36.34 39.91 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.663 -0.78 . . . . 51.02 112.169 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.765 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.2 t90 -78.28 -33.62 49.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.909 0.385 . . . . 72.15 111.109 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -64.42 -38.26 90.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.088 -0.506 . . . . 55.2 110.489 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -73.5 -30.62 63.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.901 -0.59 . . . . 73.02 110.619 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.605 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -79.74 -55.96 4.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.496 . . . . 65.51 111.106 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.701 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 5.3 mt -59.69 -28.78 67.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.933 -0.576 . . . . 74.54 110.809 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.4 mt -60.42 -32.02 70.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.425 . . . . 64.03 110.789 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 63.9 p -92.41 2.45 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 65.03 111.407 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.402 ' HB3' HD12 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -76.24 150.04 37.09 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.741 0.305 . . . . 65.24 110.769 179.916 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.4 165.38 13.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 63.24 111.206 -179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 184' ' ' LYS . . . . . 0.69 ' HA ' HD22 ' A' ' 220' ' ' LEU . 1.0 OUTLIER -60.49 117.62 5.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.951 -0.568 . . . . 72.52 110.8 179.807 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.53 66.41 2.25 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.675 -0.774 . . . . 71.24 112.319 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 186' ' ' GLU . . . . . 0.504 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.8 tt0 -144.51 145.81 32.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.602 0.239 . . . . 73.12 110.389 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 187' ' ' LYS . . . . . 0.449 ' HE2' ' HB2' ' A' ' 9' ' ' ALA . 0.5 OUTLIER -117.55 134.72 54.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.688 0.28 . . . . 74.12 110.332 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.29 168.0 20.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.113 0.482 . . . . 61.23 111.648 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.56 104.43 5.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.64 -0.709 . . . . 70.43 109.882 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.687 HD12 HD11 ' A' ' 192' ' ' ILE . 0.4 OUTLIER -126.52 147.18 49.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.081 0.467 . . . . 45.13 111.832 -179.069 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.843 ' HG3' HG23 ' A' ' 215' ' ' THR . 1.3 mp0 -117.07 125.17 50.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.689 -0.687 . . . . 72.43 110.438 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.687 HD11 HD12 ' A' ' 190' ' ' LEU . 2.4 mm -94.32 152.15 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.881 0.372 . . . . 74.32 111.221 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -87.06 159.11 51.95 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.052 -0.522 . . . . 70.12 110.657 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.37 -44.36 38.74 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.567 2.178 . . . . 55.12 112.228 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -56.34 -39.65 73.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.268 -0.424 . . . . 74.5 111.194 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.444 ' CD2' ' HB3' ' A' ' 110' ' ' LYS . 9.9 m0 -97.37 36.95 1.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.324 -0.398 . . . . 70.11 110.99 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -164.64 -77.52 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.025 -0.534 . . . . 53.33 110.705 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 198' ' ' TYR . . . . . 0.785 ' CE2' HD11 ' A' ' 214' ' ' LEU . 22.3 m-85 -102.85 -71.22 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 71.14 110.571 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 135.32 175.87 14.06 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.839 -0.696 . . . . 62.52 112.714 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 19.8 mtpt -58.34 -32.38 68.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.879 0.371 . . . . 74.44 110.884 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 11.1 mttm -59.83 -52.95 63.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 62.12 110.729 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 103.58 176.11 26.04 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.822 -0.704 . . . . 45.2 112.499 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.431 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.4 OUTLIER -117.3 81.75 13.86 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.822 0.344 . . . . 75.11 110.791 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.12 -25.26 44.74 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.669 2.246 . . . . 64.45 112.46 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.25 -42.19 94.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.917 0.389 . . . . 64.12 111.04 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -103.82 29.81 5.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.114 -0.494 . . . . 73.25 111.212 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 39.8 mttt 56.09 28.03 12.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.258 -0.428 . . . . 73.2 111.075 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.831 HG12 HD11 ' A' ' 139' ' ' LEU . 40.0 mt -91.38 111.67 50.15 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 73.43 110.992 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -74.0 173.92 13.25 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.491 2.127 . . . . 72.32 112.474 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -51.04 137.91 44.2 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.674 2.249 . . . . 72.24 112.255 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 5.9 p30 42.11 88.81 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.151 -0.477 . . . . 71.25 111.395 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.47 116.27 21.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.319 -0.4 . . . . 55.54 111.398 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 1.6 tptm -65.66 126.58 28.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 64.2 110.378 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.785 HD11 ' CE2' ' A' ' 198' ' ' TYR . 19.1 mt -104.47 109.52 21.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.342 -0.39 . . . . 72.15 111.44 -179.458 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.843 HG23 ' HG3' ' A' ' 191' ' ' GLU . 52.4 m -102.45 137.31 40.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 70.24 110.563 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.577 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 5.5 p90 -154.94 175.26 14.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.027 0.442 . . . . 75.25 111.331 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -133.01 136.77 46.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.645 . . . . 73.43 110.523 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.765 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.1 t -123.63 150.56 27.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.072 0.463 . . . . 64.32 111.891 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -136.81 111.07 8.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.744 -0.662 . . . . 74.4 110.225 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.74 HD21 HG13 ' A' ' 223' ' ' ILE . 1.9 tt -69.93 129.28 39.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.831 0.348 . . . . 52.54 111.004 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 21.6 t -108.7 -29.32 2.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 64.54 111.421 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 222' ' ' ASP . . . . . 0.426 ' N ' HD23 ' A' ' 220' ' ' LEU . 5.7 t70 -170.66 161.34 7.49 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.91 0.386 . . . . 53.11 111.018 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.74 HG13 HD21 ' A' ' 220' ' ' LEU . 46.6 mt -139.79 110.43 4.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 74.15 111.051 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 224' ' ' ASP . . . . . 0.405 ' C ' HG22 ' A' ' 130' ' ' VAL . 27.0 t70 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 74.54 110.952 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.94 HG11 HG21 ' A' ' 136' ' ' THR . 43.0 t . . . . . 0 CA--C 1.529 0.15 0 CA-C-O 120.605 0.24 . . . . 54.24 111.055 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.43 ' HD2' ' CE2' ' A' ' 72' ' ' PHE . 95.1 Cg_endo -78.72 143.84 19.05 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.667 2.244 . . . . 75.54 112.408 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -81.67 151.34 27.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 64.35 110.774 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.57 113.99 0.95 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 74.23 111.182 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -88.07 -16.34 33.84 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.14 -0.482 . . . . 55.22 111.351 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.414 ' CH2' ' HB3' ' A' ' 24' ' ' ASP . 3.9 m-90 -136.34 173.63 11.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.836 0.35 . . . . 63.31 110.719 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.1 m -115.82 150.33 37.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.069 -0.514 . . . . 72.52 110.617 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.626 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.9 t -56.3 -32.06 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.958 0.409 . . . . 71.14 110.772 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -77.01 -24.66 52.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.926 -0.579 . . . . 60.22 111.156 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.421 ' O ' ' HB2' ' A' ' 17' ' ' SER . 3.4 tt0 -82.12 -57.25 3.48 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.851 0.358 . . . . 74.34 110.911 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.631 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.2 mt -51.3 -60.31 3.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.253 -0.43 . . . . 74.24 111.012 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.626 ' HD2' HG12 ' A' ' 12' ' ' VAL . 21.7 mtt180 -57.51 -25.43 59.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.031 -0.531 . . . . 72.53 111.33 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.421 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -59.02 173.06 0.49 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.847 0.356 . . . . 72.32 110.983 -179.867 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -99.78 16.18 24.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.095 -0.502 . . . . 74.12 111.207 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -112.31 -30.35 7.21 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.421 -0.354 . . . . 73.34 110.805 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.924 HD12 HD11 ' A' ' 25' ' ' ILE . 2.4 tm? -75.26 114.27 33.78 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 44.33 110.673 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.681 ' HD2' HD22 ' A' ' 20' ' ' LEU . 34.4 Cg_endo -64.91 123.3 11.42 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.389 2.059 . . . . 71.1 112.488 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.404 ' HB2' ' CD1' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -62.75 -26.52 68.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.04 -0.527 . . . . 75.23 111.254 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.483 ' HA ' HD12 ' A' ' 26' ' ' ILE . 4.2 ttmt -53.54 -37.02 62.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.877 0.37 . . . . 73.42 111.174 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.414 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 0.1 OUTLIER -74.41 -56.1 5.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 72.2 110.845 179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.924 HD11 HD12 ' A' ' 20' ' ' LEU . 42.5 mt -44.89 -32.09 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.83 -0.623 . . . . 72.54 111.44 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.642 ' HB ' HG23 ' A' ' 47' ' ' ILE . 7.6 mt -76.66 -40.68 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 60.03 111.038 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -71.42 -24.91 62.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.893 -0.594 . . . . 73.14 111.21 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -72.36 -45.5 59.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.949 0.404 . . . . 75.42 110.886 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.785 HD21 ' HA ' ' A' ' 63' ' ' TYR . 3.6 mt -68.41 -25.09 64.86 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.859 -0.609 . . . . 73.24 111.053 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -80.95 -24.44 38.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.31 -0.404 . . . . 70.5 111.177 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.42 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -101.26 -7.35 23.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.469 -0.332 . . . . 74.13 111.503 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.42 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.9 m-70 -125.78 -3.13 7.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.7 -0.227 . . . . 73.45 111.606 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.43 161.37 19.91 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.707 -0.758 . . . . 54.33 112.418 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -89.68 149.45 22.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.588 0.233 . . . . 62.42 110.61 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.657 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -49.1 -57.0 7.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.801 0.334 . . . . 73.21 111.075 -179.798 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 14.5 m -47.24 -51.61 18.29 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.217 -0.447 . . . . 71.43 110.852 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.49 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 12.8 t80 -55.19 -44.3 75.19 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.857 -0.61 . . . . 54.53 110.323 179.56 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.583 HD12 ' HA ' ' A' ' 35' ' ' ASP . 13.4 mt -65.38 -42.4 92.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.015 -0.539 . . . . 73.43 110.665 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.819 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -46.48 -45.35 18.28 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.223 -0.444 . . . . 73.11 111.171 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.28 -25.74 64.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.857 -0.611 . . . . 71.04 110.859 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 67.0 m-70 -112.69 8.49 19.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.253 -0.43 . . . . 74.33 111.166 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt 54.38 33.7 19.14 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.804 0.335 . . . . 74.11 110.905 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.735 HD13 HD13 ' A' ' 29' ' ' LEU . 61.8 mt -92.39 -24.9 18.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 51.54 111.758 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.819 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -73.79 156.66 37.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.092 0.472 . . . . 72.14 111.185 -179.568 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.4 -122.75 5.7 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.671 -0.695 . . . . 61.43 112.378 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.789 ' O ' HG23 ' A' ' 50' ' ' VAL . 4.1 m120 -116.31 119.48 35.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.787 0.327 . . . . 64.03 110.93 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.642 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -45.96 -53.22 2.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.224 -0.444 . . . . 74.35 111.337 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -47.93 -38.2 16.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.887 -0.597 . . . . 54.11 110.961 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -85.61 -25.57 26.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 74.22 111.059 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.789 HG23 ' O ' ' A' ' 46' ' ' ASN . 26.3 t -81.86 -25.83 9.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.343 -0.389 . . . . 62.44 111.396 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.97 -17.13 63.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.384 -0.371 . . . . 73.55 111.438 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.2 pttt -95.19 -35.37 11.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.445 -0.343 . . . . 70.24 110.941 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.4 m -86.2 -23.38 26.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.202 -0.453 . . . . 72.04 111.105 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -101.97 125.9 48.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.373 -0.376 . . . . 74.23 111.161 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.29 175.28 10.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 53.52 110.559 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.684 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -58.1 -58.28 9.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.823 0.344 . . . . 74.12 110.51 179.956 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.86 -26.08 68.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.109 -0.496 . . . . 74.33 110.578 179.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.48 -43.21 99.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.114 -0.494 . . . . 72.33 110.341 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.619 HD21 HG12 ' A' ' 26' ' ' ILE . 20.8 mt -75.04 -30.11 60.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.631 -0.713 . . . . 65.32 110.998 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 56' ' ' LYS . 14.0 t -79.14 -43.14 24.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.984 0.421 . . . . 65.44 110.759 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.9 m -60.27 -36.21 77.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.823 -0.626 . . . . 72.44 110.707 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.481 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -80.85 -22.31 40.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 75.22 111.0 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.785 ' HA ' HD21 ' A' ' 29' ' ' LEU . 14.2 t80 -83.76 -22.89 31.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.117 -0.492 . . . . 70.25 110.956 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.441 ' ND2' HG12 ' A' ' 60' ' ' VAL . 72.5 m-20 -84.99 -54.35 4.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 75.34 111.342 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.466 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 2.5 p-80 -61.39 -24.49 66.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.06 -0.518 . . . . 75.45 111.179 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.766 HD12 HD23 ' A' ' 29' ' ' LEU . 3.9 tt -55.39 -39.33 70.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.937 0.399 . . . . 53.11 110.835 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -78.25 -38.82 41.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.025 -0.534 . . . . 71.33 110.705 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -37.46 78.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.013 -0.54 . . . . 62.03 111.002 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 45.4 p -90.02 -9.53 48.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.079 -0.509 . . . . 51.1 111.489 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.478 ' HD3' HG11 ' A' ' 144' ' ' VAL . 0.1 OUTLIER 52.25 34.1 13.96 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.764 0.316 . . . . 75.54 111.186 179.833 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.5 mtt180 -93.63 45.18 1.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.289 -0.414 . . . . 72.44 111.048 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.599 ' CE2' HD22 ' A' ' 66' ' ' LEU . 89.9 m-85 -69.0 178.73 2.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.43 . . . . 72.51 110.824 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.3 tttt . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.229 -0.441 . . . . 62.12 110.872 179.909 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.433 ' HE2' ' CD1' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.807 0.337 . . . . 70.4 110.967 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 19.1 p90 -130.88 151.06 51.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 72.44 110.819 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 4.8 m -120.27 128.7 53.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.272 -0.422 . . . . 74.12 110.683 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -124.66 144.25 50.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.338 -0.392 . . . . 71.21 111.0 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.1 t -145.36 117.18 8.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 62.43 110.909 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 24.1 t -74.78 107.31 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 74.4 111.147 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.415 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.9 mm? -77.45 -53.93 7.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 72.42 111.005 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -120.68 108.19 13.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 73.44 111.096 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.75 149.63 21.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 74.11 110.87 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.522 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -121.88 -155.04 9.32 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.637 -0.792 . . . . 71.31 112.662 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -37.93 -53.4 1.34 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.964 0.411 . . . . 73.23 111.436 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.65 36.04 1.32 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.87 -0.604 . . . . 75.31 110.18 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 24.2 m -153.53 -44.09 0.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.645 -0.707 . . . . 70.41 110.663 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -92.82 96.71 10.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 62.54 110.819 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -108.76 151.27 41.67 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 73.32 110.893 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.693 ' HB3' HG11 ' A' ' 166' ' ' VAL . 52.9 Cg_exo -55.04 125.59 19.7 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.517 2.145 . . . . 51.24 112.36 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -101.91 145.55 29.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.098 -0.501 . . . . 74.52 110.9 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -55.21 113.32 1.34 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.255 -0.429 . . . . 63.4 110.95 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.23 -19.61 48.05 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.644 -0.789 . . . . 72.01 112.577 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.59 138.22 31.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.8 0.333 . . . . 75.44 110.823 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.6 HG12 ' HG3' ' A' ' 165' ' ' LYS . 20.8 m -68.58 172.1 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.05 0.452 . . . . 73.25 111.415 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.899 HG22 ' O ' ' A' ' 164' ' ' PHE . 19.5 m -156.75 144.36 10.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.612 -0.722 . . . . 74.43 110.19 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.564 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -127.76 117.85 22.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.759 0.314 . . . . 71.24 110.99 -179.85 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.459 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 27.0 p -154.76 168.82 25.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.36 -0.382 . . . . 72.13 111.093 -179.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.564 ' O ' HG13 ' A' ' 218' ' ' VAL . 75.5 m95 -102.18 161.58 13.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.057 -0.52 . . . . 64.43 110.129 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.504 ' OH ' HD13 ' A' ' 162' ' ' LEU . 14.1 p90 -159.27 135.05 8.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.042 0.449 . . . . 72.21 111.65 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.94 HG21 HG11 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -127.45 112.92 15.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.792 -0.64 . . . . 71.55 110.394 179.65 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.558 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.94 144.88 17.6 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.564 -0.827 . . . . 64.01 113.137 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.727 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -151.25 140.64 21.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.725 0.298 . . . . 65.15 110.473 179.695 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.43 HD21 HG23 ' A' ' 208' ' ' ILE . 99.2 mt -78.09 -178.04 5.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.325 -0.398 . . . . 72.51 111.173 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -59.04 -42.89 91.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.969 -0.559 . . . . 74.13 110.857 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.31 -4.68 37.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.976 -0.556 . . . . 74.43 111.413 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 142' ' ' GLY . . . . . 0.498 ' C ' HG22 ' A' ' 138' ' ' THR . . . 89.47 22.0 38.8 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.687 -0.768 . . . . 74.31 112.696 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.85 108.31 19.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.859 0.362 . . . . 73.5 110.683 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.672 ' CG1' HG23 ' A' ' 138' ' ' THR . 3.5 m -68.33 130.33 33.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 64.43 111.247 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.499 ' HB3' HD11 ' A' ' 208' ' ' ILE . 34.8 p90 -110.95 -31.04 7.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 62.21 110.919 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -140.23 124.8 18.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 74.43 110.983 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.843 HG23 HG23 ' A' ' 136' ' ' THR . 29.4 m -142.59 102.86 4.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 61.23 110.736 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 45.3 t30 -76.15 -6.27 50.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 73.11 111.387 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.688 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.6 mp . . . . . 0 C--N 1.33 -0.268 0 CA-C-O 120.844 0.354 . . . . 63.13 111.036 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.834 0.35 . . . . 53.05 111.083 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 17.9 mttt -146.42 109.16 4.19 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 73.33 110.917 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 161' ' ' PRO . . . . . 0.404 ' HB2' ' HB3' ' A' ' 132' ' ' HIS . 77.2 Cg_exo -50.63 150.37 12.18 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.442 2.095 . . . . 64.31 112.327 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.504 HD13 ' OH ' ' A' ' 135' ' ' TYR . 3.7 tt -74.21 119.28 18.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 60.24 110.631 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.703 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.45 122.1 42.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.885 0.374 . . . . 72.12 111.237 -179.813 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.899 ' O ' HG22 ' A' ' 131' ' ' VAL . 6.8 p90 -151.52 143.1 23.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 74.43 110.874 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.6 ' HG3' HG12 ' A' ' 130' ' ' VAL . 64.3 mttt -78.0 138.28 38.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.037 0.446 . . . . 60.54 111.151 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.693 HG11 ' HB3' ' A' ' 125' ' ' PRO . 28.6 m -87.78 149.11 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.831 -0.622 . . . . 74.11 111.133 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.03 22.57 78.48 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.858 -0.687 . . . . 60.33 112.737 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.561 HG22 ' O ' ' A' ' 165' ' ' LYS . 17.9 m -128.55 42.87 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.846 0.355 . . . . 52.44 111.172 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 40.48 38.19 1.39 Allowed Glycine 0 C--N 1.333 0.391 0 CA-C-N 116.013 -0.54 . . . . 74.31 113.461 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.64 -47.1 10.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.862 0.363 . . . . 74.41 111.131 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.9 m -112.04 -179.9 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.072 -0.513 . . . . 71.22 111.079 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.549 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -60.54 160.62 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.303 -0.408 . . . . 72.25 111.377 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 173' ' ' ARG . . . . . 0.405 ' HA ' ' OD2' ' A' ' 176' ' ' ASP . 27.6 ttt180 -67.72 -25.83 65.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.1 -0.5 . . . . 75.35 111.285 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -80.31 -33.69 31.33 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.63 -0.795 . . . . 60.13 112.399 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.783 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.5 t90 -80.8 -35.69 32.68 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.071 0.397 . . . . 70.11 112.071 -179.157 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 176' ' ' ASP . . . . . 0.405 ' OD2' ' HA ' ' A' ' 173' ' ' ARG . 7.0 p30 -73.04 -31.35 64.37 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.794 0.33 . . . . 44.3 110.277 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -74.59 -30.65 61.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 72.11 110.18 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.473 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -88.0 -45.25 10.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.012 -0.54 . . . . 52.22 111.132 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.62 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 4.8 mt -57.68 -38.7 75.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.13 -0.486 . . . . 72.03 110.607 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 16.5 mt -55.4 -24.19 28.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.124 -0.489 . . . . 73.12 110.937 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.0 -3.99 56.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.227 -0.442 . . . . 54.24 111.417 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.55 154.09 27.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.776 0.322 . . . . 61.54 110.623 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.08 171.52 8.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.977 0.418 . . . . 53.41 111.447 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 184' ' ' LYS . . . . . 0.61 ' HA ' HD22 ' A' ' 220' ' ' LEU . 24.7 tttt -64.72 120.73 13.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.788 -0.642 . . . . 63.23 110.506 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 67.85 63.8 3.49 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.543 -0.837 . . . . 64.35 112.19 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 186' ' ' GLU . . . . . 0.522 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 22.3 tt0 -144.57 147.03 32.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.633 0.254 . . . . 74.25 110.403 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -119.42 136.53 54.26 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.271 -0.27 . . . . 71.23 110.271 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.28 168.53 19.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.105 0.479 . . . . 53.55 111.811 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.66 101.01 4.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.589 -0.732 . . . . 74.31 109.874 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.673 HD23 ' H ' ' A' ' 190' ' ' LEU . 2.2 pt? -118.92 145.33 45.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.069 0.462 . . . . 75.41 111.884 -178.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.722 ' HB3' HG23 ' A' ' 215' ' ' THR . 16.2 pt-20 -118.14 116.21 26.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.625 -0.716 . . . . 74.23 110.248 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 192' ' ' ILE . . . . . . . . . . . . . 25.5 mt -106.89 128.7 61.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.279 -0.419 . . . . 64.44 111.589 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -61.65 164.9 8.42 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.902 -0.59 . . . . 74.22 110.615 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 194' ' ' PRO . . . . . 0.439 ' HG3' ' HA ' ' A' ' 211' ' ' ASN . 19.6 Cg_endo -58.68 -40.04 76.92 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.591 2.194 . . . . 64.31 112.291 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -53.54 -28.27 30.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 64.04 111.302 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.433 ' CD1' ' HE2' ' A' ' 110' ' ' LYS . 13.8 m0 -110.24 35.3 3.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.845 0.355 . . . . 74.15 111.091 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 197' ' ' ALA . . . . . 0.433 ' CB ' HD12 ' A' ' 214' ' ' LEU . . . -153.74 -79.93 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 74.23 111.071 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -108.37 -33.69 7.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.405 . . . . 72.13 110.771 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 111.36 177.7 20.32 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.827 -0.701 . . . . 60.55 112.652 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -59.22 -36.32 75.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 70.21 110.838 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.13 -53.15 61.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 62.42 110.653 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 119.95 -151.81 17.25 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.943 -0.646 . . . . 73.12 112.494 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.4 ' CB ' ' HB ' ' A' ' 208' ' ' ILE . 0.6 OUTLIER -143.98 78.14 14.16 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.905 0.383 . . . . 72.53 110.579 179.929 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -55.65 -21.7 32.79 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.599 2.2 . . . . 72.14 112.381 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.52 -42.12 99.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.419 -0.355 . . . . 74.52 110.955 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -111.9 22.68 14.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.188 -0.46 . . . . 65.52 111.356 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 21.5 mttp 58.52 54.46 5.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.916 0.389 . . . . 73.0 111.057 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.499 HD11 ' HB3' ' A' ' 145' ' ' PHE . 23.0 mm -108.81 111.81 60.67 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 72.01 111.017 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.75 163.2 3.04 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.475 2.117 . . . . 73.32 112.447 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.04 128.72 13.37 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.634 2.222 . . . . 71.44 112.338 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 211' ' ' ASN . . . . . 0.439 ' HA ' ' HG3' ' A' ' 194' ' ' PRO . 22.8 m-80 62.6 66.99 0.73 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.249 -0.432 . . . . 73.2 110.908 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.87 129.74 51.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.264 -0.425 . . . . 74.44 111.539 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 213' ' ' LYS . . . . . 0.514 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.0 OUTLIER -65.4 143.95 57.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.942 -0.572 . . . . 74.03 110.469 179.718 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.514 HD23 ' O ' ' A' ' 213' ' ' LYS . 9.6 mt -126.94 109.58 12.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.94 0.4 . . . . 63.55 111.779 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.722 HG23 ' HB3' ' A' ' 191' ' ' GLU . 2.7 m -107.67 138.05 44.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.974 -0.557 . . . . 75.21 110.436 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.558 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 22.7 p90 -152.41 175.31 12.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.094 0.473 . . . . 73.1 111.542 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -130.28 134.1 46.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.734 -0.666 . . . . 64.33 110.432 179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.783 HG21 ' HE1' ' A' ' 175' ' ' TRP . 5.8 t -121.73 150.43 25.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.997 0.427 . . . . 74.31 111.898 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -136.94 109.22 7.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.762 -0.654 . . . . 75.13 110.233 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.698 HD21 ' CG1' ' A' ' 223' ' ' ILE . 1.9 tt -70.06 133.25 47.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.504 -0.316 . . . . 63.43 110.975 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.402 ' N ' HD23 ' A' ' 220' ' ' LEU . 21.9 t -112.62 -29.53 2.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.238 -0.437 . . . . 70.33 111.451 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 222' ' ' ASP . . . . . 0.422 ' N ' HD23 ' A' ' 220' ' ' LEU . 9.4 t70 -169.03 158.59 8.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.907 0.384 . . . . 74.32 111.157 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.784 HG23 HG12 ' A' ' 131' ' ' VAL . 30.7 mt -141.52 111.53 3.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.109 -0.496 . . . . 74.31 111.182 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 224' ' ' ASP . . . . . 0.534 ' C ' HG22 ' A' ' 130' ' ' VAL . 33.8 t70 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.245 -0.434 . . . . 63.52 110.871 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 1.059 HG11 HG21 ' A' ' 136' ' ' THR . 29.9 t . . . . . 0 CA--C 1.529 0.138 0 CA-C-O 120.558 0.218 . . . . 62.52 111.103 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -79.68 142.53 16.16 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.65 2.234 . . . . 62.1 112.449 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -78.54 147.91 33.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.244 -0.435 . . . . 63.13 110.785 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.97 96.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.213 -0.449 . . . . 74.22 111.285 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.539 ' HB2' ' NZ ' ' A' ' 187' ' ' LYS . . . -66.99 -15.62 63.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 50.32 111.379 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.514 ' NE1' HD11 ' A' ' 20' ' ' LEU . 2.0 m-90 -135.64 173.79 11.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.907 0.384 . . . . 73.31 110.794 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.461 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.3 OUTLIER -117.0 153.26 32.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.978 -0.555 . . . . 72.33 110.517 179.661 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.583 HG12 ' HD2' ' A' ' 16' ' ' ARG . 31.7 t -56.31 -34.05 39.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.396 . . . . 74.45 110.975 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -72.8 -25.67 61.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.532 . . . . 44.13 111.197 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.461 ' HB2' HG23 ' A' ' 11' ' ' THR . 17.5 mt-30 -82.15 -56.57 3.85 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.821 0.343 . . . . 75.23 111.122 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.602 ' HB3' HG22 ' A' ' 60' ' ' VAL . 14.0 mt -49.55 -64.36 0.83 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.284 -0.417 . . . . 63.21 111.123 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.583 ' HD2' HG12 ' A' ' 12' ' ' VAL . 4.7 mtt-85 -54.45 -25.46 25.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.5 . . . . 73.34 111.345 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.13 173.24 0.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.023 0.44 . . . . 73.43 111.31 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -108.25 16.99 22.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.766 -0.652 . . . . 63.13 110.945 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.5 tp60 -107.75 -23.61 12.02 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.386 -0.37 . . . . 74.4 111.065 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.814 HD22 HD11 ' A' ' 25' ' ' ILE . 10.0 tt -93.17 116.19 66.12 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.407 -0.36 . . . . 73.22 111.029 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -57.2 126.6 22.61 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.478 2.118 . . . . 74.12 112.198 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -24.11 67.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 64.42 111.203 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.538 ' HA ' HD12 ' A' ' 26' ' ' ILE . 26.4 mmtt -53.74 -36.87 62.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.375 -0.375 . . . . 71.41 111.292 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -72.67 -57.22 4.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.266 -0.425 . . . . 73.51 111.021 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.814 HD11 HD22 ' A' ' 20' ' ' LEU . 36.5 mt -44.77 -30.56 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.892 -0.594 . . . . 71.23 111.466 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.737 ' HB ' HG23 ' A' ' 47' ' ' ILE . 7.7 mt -78.08 -38.83 24.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.931 0.396 . . . . 74.03 111.03 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 mtpt -73.78 -24.9 59.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.96 -0.564 . . . . 53.01 111.131 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -72.96 -45.19 59.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.923 0.392 . . . . 75.52 110.842 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.844 HD23 HD12 ' A' ' 66' ' ' LEU . 3.2 mt -69.27 -24.53 63.98 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.911 -0.586 . . . . 75.22 111.033 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.52 ' HA ' HD11 ' A' ' 38' ' ' LEU . 64.8 mt-30 -80.0 -26.89 39.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.407 . . . . 61.45 111.112 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.425 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -101.8 -1.3 32.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.415 -0.357 . . . . 60.23 111.593 -179.889 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.425 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.7 m-70 -132.6 -10.9 3.14 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.857 0.317 . . . . 74.54 111.857 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.86 105.49 0.81 Allowed Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.603 -0.808 . . . . 54.11 112.372 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -31.94 152.48 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.544 0.572 . . . . 63.45 112.544 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.579 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.6 p-10 -50.09 -56.8 9.41 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.692 -0.685 . . . . 71.21 111.292 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.52 -49.96 17.82 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.032 0.444 . . . . 71.42 110.77 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.453 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 2.4 t80 -52.99 -47.26 68.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.786 -0.643 . . . . 74.1 110.321 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.693 HD21 ' O ' ' A' ' 29' ' ' LEU . 12.1 mt -66.86 -41.48 87.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.938 -0.574 . . . . 65.44 110.853 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.838 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -48.64 -41.84 32.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.093 0.473 . . . . 43.53 110.75 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -49.4 -48.28 47.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.678 -0.692 . . . . 63.3 110.93 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.418 ' CD2' ' N ' ' A' ' 41' ' ' HIS . 2.9 m-70 -103.89 14.86 29.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.042 -0.526 . . . . 74.34 111.201 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 4.8 mtmm 55.51 42.14 30.09 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.889 0.376 . . . . 51.14 111.1 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.708 HD13 HD13 ' A' ' 29' ' ' LEU . 20.3 mt -93.24 -19.43 21.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 65.44 111.532 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.838 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.73 157.81 27.07 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.04 0.448 . . . . 71.41 111.077 -179.863 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.73 -121.55 5.13 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.747 -0.661 . . . . 51.13 112.379 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.787 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.4 OUTLIER -116.36 116.88 28.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.773 0.321 . . . . 54.41 110.92 179.917 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.737 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.9 -54.72 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.237 -0.438 . . . . 73.32 111.33 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -47.09 -36.75 8.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 74.51 110.849 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -85.67 -26.03 26.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.93 -0.577 . . . . 73.12 110.959 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 46' ' ' ASN . 22.8 t -79.8 -26.03 12.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.293 -0.412 . . . . 70.51 111.353 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.61 -23.13 66.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 53.42 111.126 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.21 -30.43 14.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 54.23 110.758 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.2 m -98.2 33.74 2.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 62.14 111.053 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -165.4 135.05 3.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 45.23 111.027 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -94.03 177.33 6.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 74.11 110.964 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.629 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -56.04 -57.79 10.63 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.26 -0.427 . . . . 73.23 111.053 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -58.73 -28.31 65.73 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 70.33 110.577 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.27 -47.25 85.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.957 -0.565 . . . . 54.33 110.905 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.688 HD21 HG12 ' A' ' 26' ' ' ILE . 31.7 mt -73.9 -30.94 62.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.654 -0.703 . . . . 74.41 111.283 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.629 HG23 ' O ' ' A' ' 56' ' ' LYS . 22.3 t -78.84 -43.23 25.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.986 0.422 . . . . 73.34 111.007 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 96.6 m -60.48 -37.84 82.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.945 -0.571 . . . . 72.41 110.71 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.479 ' HB3' HD11 ' A' ' 43' ' ' LEU . . . -78.21 -23.41 47.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 62.24 111.081 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.666 ' HA ' HD21 ' A' ' 29' ' ' LEU . 19.2 t80 -83.96 -53.52 5.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.148 0.499 . . . . 71.14 110.656 179.415 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.585 ' ND2' HG12 ' A' ' 60' ' ' VAL . 31.2 m-20 -50.56 -57.01 9.15 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.514 -0.766 . . . . 73.24 111.371 -179.569 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.459 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 3.0 p-80 -63.47 -24.86 68.01 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.155 -0.475 . . . . 73.43 111.193 -179.618 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.844 HD12 HD23 ' A' ' 29' ' ' LEU . 3.7 tt -51.95 -41.39 62.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.907 0.384 . . . . 54.21 110.891 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -79.04 -40.09 32.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.975 -0.557 . . . . 73.25 110.553 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -62.39 -45.19 94.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.979 -0.555 . . . . 65.42 110.676 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 72.7 p -90.75 -1.99 57.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.93 -0.577 . . . . 64.23 111.346 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.1 pttt 45.06 42.16 6.24 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.794 0.331 . . . . 74.12 111.554 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -92.11 47.24 1.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 73.25 110.884 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.517 ' CE2' HD22 ' A' ' 66' ' ' LEU . 87.3 m-85 -73.05 -175.0 1.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 75.31 110.924 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.6 tttt . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.415 . . . . 75.4 110.857 179.907 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.439 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.795 0.331 . . . . 75.4 110.962 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.403 ' CE1' ' HB2' ' A' ' 178' ' ' ALA . 47.3 p90 -151.98 163.73 38.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 73.11 110.852 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' THR . . . . . 0.433 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 64.1 m -130.2 103.57 6.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 73.55 110.939 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.46 146.42 34.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 75.21 110.897 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.531 ' O ' HD12 ' A' ' 116' ' ' LEU . 2.1 m -142.23 125.75 16.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 72.14 110.925 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.517 HG13 ' CD ' ' A' ' 186' ' ' GLU . 41.8 t -72.68 106.11 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 62.44 111.451 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.531 HD12 ' O ' ' A' ' 114' ' ' SER . 6.8 mp -75.62 -60.71 2.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 73.32 110.484 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.0 ttpp -111.62 108.07 17.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.954 -0.566 . . . . 73.44 110.64 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.4 mtpt -60.21 137.37 58.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.26 -0.427 . . . . 63.21 111.024 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -104.19 -106.01 3.05 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.762 -0.733 . . . . 61.33 112.198 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.22 -43.94 11.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.958 0.408 . . . . 75.23 110.589 179.746 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 71.05 36.44 1.42 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.909 -0.587 . . . . 72.51 110.679 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 60.1 m -163.97 -43.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.017 -0.538 . . . . 74.21 110.768 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.35 91.72 6.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 73.21 110.952 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -103.34 149.89 37.43 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.129 -0.487 . . . . 71.33 110.906 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.613 ' HB2' HG21 ' A' ' 166' ' ' VAL . 61.2 Cg_endo -73.14 125.66 10.5 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.597 2.198 . . . . 75.03 112.387 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.91 159.38 15.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 72.55 110.8 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.418 ' HG2' ' HA3' ' A' ' 167' ' ' GLY . 0.0 OUTLIER -58.53 118.45 5.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.343 -0.39 . . . . 74.33 110.965 -179.947 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 103.0 -17.72 51.6 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.762 -0.732 . . . . 4.34 112.499 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.41 133.35 35.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.902 0.382 . . . . 74.23 110.903 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.566 HG12 ' O ' ' A' ' 224' ' ' ASP . 5.7 p -69.96 162.8 3.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.506 . . . . 63.13 110.848 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.77 HG22 ' O ' ' A' ' 164' ' ' PHE . 5.4 m -153.16 144.85 15.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.206 -0.452 . . . . 61.31 111.048 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.597 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -127.48 117.8 22.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.768 0.318 . . . . 71.33 110.725 179.68 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.488 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.1 p -154.76 168.87 25.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.901 0.381 . . . . 65.35 111.067 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.525 ' O ' HG13 ' A' ' 218' ' ' VAL . 65.2 m95 -102.91 162.62 12.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.012 -0.54 . . . . 71.43 110.195 179.45 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.69 ' H ' HD11 ' A' ' 149' ' ' ILE . 33.2 p90 -159.93 135.2 8.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.982 0.42 . . . . 72.53 111.458 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' THR . . . . . 1.059 HG21 HG11 ' A' ' 5' ' ' VAL . 6.8 m -129.32 115.38 17.5 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.847 -0.615 . . . . 62.31 110.337 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.597 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.82 144.26 17.15 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.619 -0.8 . . . . 73.35 113.108 -179.478 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.74 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -148.11 145.98 28.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.784 0.326 . . . . 74.22 110.548 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 21.9 mt -82.27 -177.97 6.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.277 -0.42 . . . . 64.24 111.159 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -57.63 -42.48 83.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 72.32 110.937 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.94 -5.4 46.0 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.016 -0.538 . . . . 50.53 111.405 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.64 25.84 26.64 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.64 -0.79 . . . . 73.53 112.546 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -95.35 112.2 23.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.339 . . . . 53.12 110.771 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.574 ' CG1' HG23 ' A' ' 138' ' ' THR . 2.5 m -63.6 144.15 14.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.436 . . . . 73.52 111.17 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.434 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 42.2 p90 -120.92 -36.56 3.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 73.53 111.284 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 146' ' ' ASP . . . . . 0.404 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 59.7 m-20 -158.07 118.04 3.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.906 0.384 . . . . 71.21 111.355 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.444 ' OG1' HG23 ' A' ' 136' ' ' THR . 14.7 t -142.94 129.46 20.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.514 . . . . 64.5 110.491 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.692 ' C ' HD12 ' A' ' 149' ' ' ILE . 19.8 p-10 -96.22 39.32 1.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.8 0.333 . . . . 74.33 111.1 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.692 HD12 ' C ' ' A' ' 148' ' ' ASN . 2.7 mp . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 74.31 110.713 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.78 0.324 . . . . 63.44 111.04 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -136.83 138.4 26.01 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 73.05 110.904 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.76 151.62 31.6 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.384 2.056 . . . . 72.41 112.359 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.569 ' O ' HD23 ' A' ' 162' ' ' LEU . 4.6 tt -76.08 119.95 20.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 61.23 110.572 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.62 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -98.68 122.17 41.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.907 0.384 . . . . 72.51 111.273 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.77 ' O ' HG22 ' A' ' 131' ' ' VAL . 8.4 p90 -151.62 143.55 23.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.014 -0.539 . . . . 75.1 110.724 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.532 ' O ' HG22 ' A' ' 168' ' ' VAL . 14.7 mtmm -80.92 139.11 36.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.082 0.468 . . . . 74.42 111.129 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.613 HG21 ' HB2' ' A' ' 125' ' ' PRO . 34.1 m -87.46 149.46 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.71 -0.677 . . . . 70.23 111.44 -179.127 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 167' ' ' GLY . . . . . 0.418 ' HA3' ' HG2' ' A' ' 127' ' ' LYS . . . 70.51 22.54 77.84 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.82 -0.627 . . . . 64.14 112.768 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.614 HG23 ' CG ' ' A' ' 170' ' ' LYS . 17.1 m -129.38 42.29 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 75.42 111.096 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.69 37.47 5.14 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 121.143 -0.551 . . . . 73.22 113.088 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 170' ' ' LYS . . . . . 0.614 ' CG ' HG23 ' A' ' 168' ' ' VAL . 3.0 mmpt? -86.02 -36.8 19.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.819 0.342 . . . . 61.52 111.131 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.6 m -126.76 179.39 3.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.457 . . . . 72.21 111.19 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.543 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -60.57 159.45 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 73.21 111.301 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -67.41 -27.8 67.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 74.41 111.199 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.96 -36.97 39.75 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.662 -0.78 . . . . 74.04 112.059 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.67 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.4 t90 -78.3 -34.15 48.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.957 0.408 . . . . 74.21 111.113 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 176' ' ' ASP . . . . . 0.808 ' O ' HD13 ' A' ' 180' ' ' LEU . 35.1 t70 -66.78 -32.21 73.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.948 -0.569 . . . . 54.43 110.675 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -79.06 -29.82 43.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.48 . . . . 72.33 110.837 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.656 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -82.58 -52.38 6.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.234 -0.439 . . . . 75.44 111.181 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.566 HD21 ' NE1' ' A' ' 175' ' ' TRP . 10.2 mt -58.4 -34.89 71.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.988 -0.551 . . . . 73.22 110.842 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.808 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.6 mp -53.68 -37.62 63.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 70.3 111.084 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 39.2 p -84.18 1.99 41.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.037 -0.529 . . . . 73.03 111.518 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.15 151.38 33.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.765 0.317 . . . . 71.24 110.863 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.72 165.76 11.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.291 -0.413 . . . . 71.42 110.938 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.89 124.97 23.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.08 -0.509 . . . . 73.02 111.021 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 67.8 44.15 81.25 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.84 -0.695 . . . . 63.22 112.841 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 186' ' ' GLU . . . . . 0.517 ' CD ' HG13 ' A' ' 115' ' ' VAL . 13.4 tt0 -126.91 149.94 49.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.581 0.229 . . . . 52.2 110.528 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 187' ' ' LYS . . . . . 0.539 ' NZ ' ' HB2' ' A' ' 9' ' ' ALA . 4.7 ttmt -117.95 138.17 52.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.098 -0.334 . . . . 64.43 110.098 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -148.23 175.85 10.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.075 0.464 . . . . 54.4 111.846 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.13 133.6 33.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.607 -0.724 . . . . 71.33 109.584 178.726 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.656 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.1 pt? -140.34 141.18 35.69 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.158 0.504 . . . . 73.53 112.045 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.68 110.36 18.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.587 -0.733 . . . . 72.04 110.257 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.482 HD11 ' CZ ' ' A' ' 216' ' ' PHE . 2.1 mp -96.25 139.44 19.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.916 0.389 . . . . 74.12 111.344 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -73.64 166.38 44.69 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.945 -0.57 . . . . 74.35 110.964 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.56 -14.34 41.87 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.676 2.25 . . . . 73.44 112.608 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -80.38 -30.01 37.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.814 0.34 . . . . 72.43 111.028 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.439 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 15.3 m0 -111.06 36.9 2.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.29 -0.413 . . . . 71.33 111.004 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -153.16 -78.4 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.256 -0.429 . . . . 74.52 111.018 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 198' ' ' TYR . . . . . 0.668 ' CE2' HD11 ' A' ' 214' ' ' LEU . 24.0 m-85 -106.92 -71.17 0.76 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 62.1 110.792 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 145.74 176.04 19.32 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.83 -0.7 . . . . 51.43 112.596 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -57.5 -25.58 60.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.728 0.299 . . . . 72.22 111.005 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -74.68 -52.02 12.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.998 0.427 . . . . 74.25 110.863 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.78 174.01 24.67 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.854 -0.689 . . . . 54.21 112.533 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.429 ' CB ' HD12 ' A' ' 208' ' ' ILE . 0.0 OUTLIER -106.32 91.27 5.54 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.66 0.267 . . . . 75.1 110.845 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 204' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 203' ' ' GLN . 37.4 Cg_endo -66.22 -21.61 54.84 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.509 2.139 . . . . 74.01 112.445 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.39 -41.84 94.65 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.383 -0.371 . . . . 71.11 110.932 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -105.96 30.0 6.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 72.32 111.126 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 21.6 mttp 56.8 29.43 16.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 72.24 111.044 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.606 HD13 ' CE2' ' A' ' 198' ' ' TYR . 30.3 mt -91.11 111.77 50.3 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.304 -0.407 . . . . 60.42 111.013 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -68.55 171.23 13.43 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.461 2.107 . . . . 73.31 112.401 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -67.01 145.84 75.16 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.587 2.191 . . . . 74.41 112.253 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 48.92 73.61 0.22 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.255 -0.429 . . . . 71.25 111.152 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -127.37 113.66 16.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.312 -0.404 . . . . 50.24 111.479 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.08 116.5 6.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.054 -0.521 . . . . 74.04 110.44 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.668 HD11 ' CE2' ' A' ' 198' ' ' TYR . 11.1 mt -93.46 109.87 21.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.162 -0.472 . . . . 63.14 111.568 -179.26 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 96.4 m -107.43 138.13 44.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.935 -0.575 . . . . 65.15 110.303 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.597 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 14.9 p90 -155.33 179.38 9.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.082 0.467 . . . . 73.24 111.552 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -133.48 136.85 45.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.686 -0.688 . . . . 75.31 110.748 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.67 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.0 t -121.8 151.21 25.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.168 -0.469 . . . . 34.41 111.756 -179.072 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -136.74 108.78 7.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.793 -0.639 . . . . 71.22 110.365 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.892 HD13 HD11 ' A' ' 223' ' ' ILE . 0.7 OUTLIER -69.83 128.56 36.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.364 -0.38 . . . . 61.32 110.829 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 39.3 t -108.7 -30.05 2.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.25 -0.432 . . . . 71.2 111.023 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -167.14 156.81 10.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.354 -0.384 . . . . 72.42 110.948 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.892 HD11 HD13 ' A' ' 220' ' ' LEU . 4.4 mp -142.75 112.35 2.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.239 -0.437 . . . . 75.43 111.097 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 224' ' ' ASP . . . . . 0.566 ' O ' HG12 ' A' ' 130' ' ' VAL . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 61.52 110.89 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 1.037 HG11 HG21 ' A' ' 136' ' ' THR . 44.7 t . . . . . 0 CA--C 1.529 0.138 0 CA-C-O 120.634 0.254 . . . . 72.12 110.951 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.443 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 80.3 Cg_endo -78.56 141.96 18.0 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.713 2.275 . . . . 62.02 112.473 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.406 HE22 HD11 ' A' ' 149' ' ' ILE . 5.5 mm100 -79.91 149.35 30.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.126 -0.488 . . . . 73.45 110.975 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.429 ' HD2' HD13 ' A' ' 149' ' ' ILE . 0.0 OUTLIER -49.86 116.61 1.88 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 72.04 111.162 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.29 -13.9 34.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.146 -0.479 . . . . 55.23 111.576 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.678 ' CD1' HD11 ' A' ' 20' ' ' LEU . 2.0 m-90 -137.94 173.73 11.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.961 0.41 . . . . 73.41 110.966 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 m -117.51 151.8 36.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.944 -0.571 . . . . 51.33 110.741 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.554 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.8 t -56.7 -33.09 39.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.948 0.404 . . . . 63.51 110.824 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -75.4 -25.61 57.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.949 -0.568 . . . . 75.32 111.017 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -82.12 -57.45 3.39 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.831 0.348 . . . . 74.14 110.929 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.708 HD23 HG12 ' A' ' 25' ' ' ILE . 1.0 OUTLIER -49.7 -62.98 1.25 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.241 -0.436 . . . . 70.42 111.006 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.554 ' HD2' HG12 ' A' ' 12' ' ' VAL . 17.9 mtt180 -54.07 -24.09 16.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.087 -0.506 . . . . 70.22 111.291 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.31 176.84 0.11 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.891 0.377 . . . . 72.41 111.168 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -110.38 16.81 21.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.98 -0.554 . . . . 72.55 111.194 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -108.9 -24.81 11.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.521 -0.309 . . . . 75.43 111.165 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.678 HD11 ' CD1' ' A' ' 10' ' ' TRP . 1.8 tt -90.95 111.69 49.59 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.388 -0.369 . . . . 75.11 111.03 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -55.97 128.09 28.8 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.448 2.099 . . . . 75.22 112.211 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.874 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -62.66 -24.16 67.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 73.32 111.222 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.468 ' HA ' HD12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -52.04 -41.62 62.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.425 -0.352 . . . . 75.3 111.472 -179.747 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.95 -57.34 4.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.197 -0.456 . . . . 53.01 111.104 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.874 HD12 ' HA ' ' A' ' 22' ' ' LYS . 4.9 mt -44.96 -30.49 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.858 -0.61 . . . . 70.4 111.613 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.665 HG12 HD21 ' A' ' 59' ' ' LEU . 7.5 mt -77.74 -37.85 24.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.938 0.399 . . . . 70.24 110.969 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -73.11 -23.75 60.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.062 -0.517 . . . . 71.31 111.03 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.452 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 34.6 t80 -73.22 -47.02 46.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.06 0.457 . . . . 75.21 110.99 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.815 HD21 ' HA ' ' A' ' 63' ' ' TYR . 4.3 mt -69.11 -27.77 65.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.782 -0.645 . . . . 74.23 111.136 -179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.476 ' HA ' HD11 ' A' ' 38' ' ' LEU . 36.2 mt-30 -75.69 -29.26 58.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.405 . . . . 72.41 110.987 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.405 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 12.7 pt-20 -93.34 -39.65 10.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 71.21 111.113 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.452 ' ND1' ' CZ ' ' A' ' 28' ' ' PHE . 18.3 m170 -90.27 -5.0 56.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.294 -0.412 . . . . 64.41 111.448 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.01 161.94 15.96 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.712 -0.756 . . . . 70.45 112.425 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.81 153.38 18.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.62 0.248 . . . . 71.14 110.501 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.699 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.3 p-10 -48.83 -56.97 7.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.77 0.319 . . . . 74.42 111.066 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.14 -51.24 25.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.053 0.454 . . . . 45.24 110.803 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.508 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 16.5 t80 -53.07 -48.09 67.98 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.803 -0.635 . . . . 71.53 110.453 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.522 HD21 ' O ' ' A' ' 29' ' ' LEU . 13.3 mt -66.18 -40.67 90.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.055 -0.521 . . . . 64.23 110.775 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.767 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.65 -48.19 28.96 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.03 0.443 . . . . 34.13 111.1 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -57.33 -26.68 61.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.713 -0.676 . . . . 34.31 110.94 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.406 ' NE2' ' CE1' ' A' ' 65' ' ' HIS . 67.8 m-70 -112.57 11.07 19.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.283 -0.417 . . . . 74.54 111.248 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.89 34.79 11.0 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.817 0.341 . . . . 62.44 110.901 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.694 HD13 HD13 ' A' ' 29' ' ' LEU . 23.2 mt -93.29 -20.65 20.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 73.33 111.736 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.767 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.39 158.89 27.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.031 0.443 . . . . 71.03 111.102 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.61 -119.6 4.64 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.775 -0.648 . . . . 51.23 112.453 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.883 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.5 OUTLIER -116.4 115.16 25.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.803 0.335 . . . . 61.03 110.891 179.947 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.634 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.41 -57.66 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.164 -0.471 . . . . 73.51 111.499 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -45.68 -37.25 5.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.804 -0.634 . . . . 73.43 111.076 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -85.75 -25.92 26.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.566 . . . . 51.33 111.086 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 46' ' ' ASN . 19.2 t -81.14 -26.36 10.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.304 -0.407 . . . . 60.12 111.459 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.99 -18.02 64.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.403 -0.362 . . . . 64.33 111.365 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -95.2 -34.53 12.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.42 -0.355 . . . . 51.21 111.076 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.46 -19.74 35.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 74.22 111.409 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -116.16 139.26 50.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 64.42 111.255 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -91.42 -177.47 4.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.151 -0.477 . . . . 74.13 110.74 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.566 ' O ' HG23 ' A' ' 60' ' ' VAL . 23.1 mmmt -59.59 -58.02 10.42 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.457 -0.338 . . . . 55.33 110.91 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.94 -27.87 65.73 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.205 -0.452 . . . . 74.44 110.625 179.639 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.77 -43.11 99.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.958 -0.564 . . . . 72.4 110.756 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.665 HD21 HG12 ' A' ' 26' ' ' ILE . 29.1 mt -76.35 -28.85 56.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.687 -0.688 . . . . 75.1 111.196 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.6 HG22 ' HB3' ' A' ' 15' ' ' LEU . 18.2 t -80.42 -43.93 21.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.001 0.429 . . . . 72.44 110.685 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 72.4 m -59.29 -33.98 71.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.88 -0.6 . . . . 71.35 110.457 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.455 ' HB3' HD11 ' A' ' 43' ' ' LEU . . . -83.23 -21.97 33.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 62.14 110.942 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.815 ' HA ' HD21 ' A' ' 29' ' ' LEU . 15.6 t80 -83.64 -22.84 32.05 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.171 -0.468 . . . . 60.15 111.113 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.52 ' ND2' HG12 ' A' ' 60' ' ' VAL . 34.2 m-80 -84.56 -53.9 5.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.074 0.464 . . . . 70.04 111.321 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.589 ' HD2' HG21 ' A' ' 69' ' ' THR . 2.9 p-80 -60.43 -29.23 68.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.003 -0.544 . . . . 74.23 111.022 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.694 HD12 HD23 ' A' ' 29' ' ' LEU . 5.5 tt -46.73 -42.09 16.17 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.877 0.37 . . . . 71.33 110.985 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.42 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 5.8 m-85 -78.14 -41.08 36.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.997 -0.547 . . . . 54.43 110.276 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -70.31 -13.02 61.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.899 -0.592 . . . . 72.32 111.02 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.589 HG21 ' HD2' ' A' ' 65' ' ' HIS . 39.3 p -110.6 -16.16 13.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.267 -0.424 . . . . 64.2 111.259 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.667 ' HD3' HG21 ' A' ' 144' ' ' VAL . 10.9 mtmm 57.41 29.95 17.79 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.784 0.326 . . . . 73.32 111.043 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.1 mtt85 -95.1 44.07 1.09 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 71.43 110.993 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.433 ' CD2' ' HD2' ' A' ' 6' ' ' PRO . 61.5 m-85 -66.29 174.63 2.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 71.14 110.758 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.293 -0.412 . . . . 75.34 110.856 179.974 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.789 0.328 . . . . 54.33 110.97 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 6.2 p90 -160.99 -171.89 3.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 74.2 110.809 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 18.7 m -156.44 103.71 2.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 75.41 111.282 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.491 ' HD2' ' HB1' ' A' ' 178' ' ' ALA . 15.3 tttt -100.45 150.99 22.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.202 -0.454 . . . . 72.22 110.66 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.401 ' O ' HD22 ' A' ' 116' ' ' LEU . 65.6 m -145.49 123.11 11.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.35 -0.386 . . . . 72.43 111.037 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 32.7 t -80.77 106.36 11.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 50.31 111.187 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.533 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.1 mm? -82.27 -41.56 20.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.448 . . . . 74.1 110.683 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 8.3 tptt -125.29 108.08 11.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 73.45 110.825 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.0 mtmp? -62.1 139.27 58.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 63.41 110.945 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -110.96 -158.48 15.54 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.719 -0.753 . . . . 70.4 112.408 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -35.88 -49.21 0.61 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.913 0.387 . . . . 75.32 111.708 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.553 ' O ' HG23 ' A' ' 122' ' ' THR . 1.2 tmtt? 72.89 37.71 0.79 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.994 -0.548 . . . . 73.24 110.298 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.553 HG23 ' O ' ' A' ' 121' ' ' LYS . 0.8 OUTLIER -164.43 -44.05 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.729 -0.669 . . . . 63.21 110.55 179.874 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -84.82 91.7 8.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.066 -0.515 . . . . 71.25 110.671 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -108.89 154.98 41.55 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.466 . . . . 72.42 110.885 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.611 ' HB2' HG21 ' A' ' 166' ' ' VAL . 62.8 Cg_endo -73.58 125.63 10.23 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.546 2.164 . . . . 74.13 112.407 -179.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.07 157.37 15.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 71.01 110.891 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.0 115.36 3.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 62.41 110.958 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 108.02 -24.02 24.11 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.732 -0.747 . . . . 71.15 112.568 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -84.54 135.27 34.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 63.13 110.797 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.687 HG12 ' HG3' ' A' ' 165' ' ' LYS . 22.7 m -68.21 171.69 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.29 -0.414 . . . . 70.31 111.191 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.907 HG22 ' O ' ' A' ' 164' ' ' PHE . 10.9 m -156.13 145.31 12.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.863 -0.608 . . . . 73.54 110.593 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.437 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.3 OUTLIER -127.6 117.59 22.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.702 0.286 . . . . 75.21 110.818 179.595 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.654 ' HB3' HD22 ' A' ' 220' ' ' LEU . 30.1 p -153.47 169.09 24.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.965 0.412 . . . . 64.15 111.085 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.554 ' HB3' HD11 ' A' ' 149' ' ' ILE . 39.5 m95 -102.5 160.51 14.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.94 -0.573 . . . . 55.4 110.102 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.434 ' CD1' ' N ' ' A' ' 135' ' ' TYR . 3.2 p90 -158.84 134.7 8.87 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.734 -0.386 . . . . 73.44 111.591 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 136' ' ' THR . . . . . 1.037 HG21 HG11 ' A' ' 5' ' ' VAL . 57.0 m -127.63 112.5 14.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.958 -0.564 . . . . 62.44 110.553 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.643 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.55 143.84 16.81 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.601 -0.809 . . . . 24.1 113.197 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.739 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -151.58 131.01 12.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.724 0.297 . . . . 75.54 110.384 179.717 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.589 HD21 HD12 ' A' ' 208' ' ' ILE . 83.2 mt -59.24 -178.74 0.06 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.399 -0.364 . . . . 52.14 110.951 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -55.24 -40.9 71.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 65.11 110.852 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.56 0.67 41.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.012 -0.54 . . . . 72.21 111.476 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.75 25.82 26.46 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.612 -0.804 . . . . 63.54 112.64 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' THR . . . . . 0.563 ' HB ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -81.17 108.67 15.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.778 0.323 . . . . 73.42 110.873 179.997 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.667 HG21 ' HD3' ' A' ' 70' ' ' LYS . 27.5 t -65.89 124.46 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.449 . . . . 74.12 111.161 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.823 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 17.7 p90 -111.49 -28.41 8.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 71.32 111.013 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -161.19 115.33 2.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.31 -0.405 . . . . 62.12 111.007 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.608 HG22 ' H ' ' A' ' 149' ' ' ILE . 55.1 m -125.36 116.41 21.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 53.14 110.891 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -86.12 14.65 6.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.921 -0.581 . . . . 55.54 111.636 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.608 ' H ' HG22 ' A' ' 147' ' ' THR . 14.8 mt . . . . . 0 C--N 1.331 -0.227 0 CA-C-O 120.767 0.318 . . . . 65.11 111.429 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.81 0.338 . . . . 31.34 111.036 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.3 mmtm -138.97 145.94 47.61 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.304 -0.407 . . . . 60.23 110.875 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.09 147.92 61.8 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.492 2.128 . . . . 70.14 112.339 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.527 HD23 ' C ' ' A' ' 162' ' ' LEU . 3.9 tt -69.38 124.72 24.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 75.4 110.682 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.664 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.29 119.64 38.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.862 0.363 . . . . 53.42 111.081 179.803 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.907 ' O ' HG22 ' A' ' 131' ' ' VAL . 5.3 p90 -149.39 140.82 23.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 70.14 110.855 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.687 ' HG3' HG12 ' A' ' 130' ' ' VAL . 75.8 mttt -78.69 139.51 38.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.009 0.433 . . . . 52.31 110.925 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.611 HG21 ' HB2' ' A' ' 125' ' ' PRO . 29.6 m -87.97 148.91 4.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.874 -0.603 . . . . 53.52 111.373 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.1 24.63 74.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.885 -0.674 . . . . 52.42 112.875 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.721 HG23 ' HG3' ' A' ' 170' ' ' LYS . 5.3 m -129.1 42.67 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.821 0.343 . . . . 52.11 111.101 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 41.8 35.45 1.51 Allowed Glycine 0 C--N 1.332 0.33 0 CA-C-N 116.046 -0.525 . . . . 72.23 113.319 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 170' ' ' LYS . . . . . 0.721 ' HG3' HG23 ' A' ' 168' ' ' VAL . 6.1 mtpp -86.24 -43.65 12.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.814 0.34 . . . . 75.41 111.163 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 5.7 m -115.24 178.17 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.195 -0.457 . . . . 75.23 110.988 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.553 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.92 160.91 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.317 -0.401 . . . . 63.2 111.192 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 3.6 ttp-105 -67.81 -29.05 68.12 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.235 -0.438 . . . . 74.23 111.044 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.9 -37.19 44.9 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.659 -0.781 . . . . 65.14 112.081 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.718 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.0 t90 -78.73 -33.99 46.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.973 0.416 . . . . 74.33 110.983 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 176' ' ' ASP . . . . . 0.775 ' O ' HD13 ' A' ' 180' ' ' LEU . 4.1 t70 -63.87 -33.87 76.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.872 -0.604 . . . . 62.43 110.497 179.722 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -78.73 -29.42 45.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.016 -0.538 . . . . 72.0 110.706 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.629 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -80.0 -56.11 4.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 61.24 111.126 179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.667 HD21 ' NE1' ' A' ' 175' ' ' TRP . 12.5 mt -61.65 -18.96 61.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.899 -0.592 . . . . 74.45 111.128 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.775 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.5 tp -58.38 -27.15 63.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.357 -0.383 . . . . 63.34 111.26 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 47.8 p -111.52 14.01 21.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.494 -0.321 . . . . 75.11 111.717 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.819 ' SD ' HD23 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -71.57 100.72 2.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.882 0.372 . . . . 74.44 110.691 179.869 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.53 159.46 24.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 75.35 111.255 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.52 116.11 4.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.859 -0.61 . . . . 70.21 111.038 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 79.17 11.84 84.64 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.936 -0.649 . . . . 54.01 113.075 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -87.39 146.31 25.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.963 0.411 . . . . 75.22 111.211 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -119.57 135.71 54.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.003 -0.544 . . . . 71.22 109.928 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -150.11 176.37 10.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.099 0.476 . . . . 63.33 111.9 -179.197 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 189' ' ' ARG . . . . . 0.404 ' CB ' ' HG2' ' A' ' 217' ' ' GLU . 0.0 OUTLIER -137.43 138.29 39.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.577 -0.738 . . . . 74.21 109.462 178.782 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.661 HD23 ' N ' ' A' ' 190' ' ' LEU . 1.1 pt? -140.15 138.16 35.0 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.281 0.562 . . . . 75.22 112.41 -179.267 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.751 ' HG2' HG23 ' A' ' 215' ' ' THR . 6.7 mt-10 -113.46 112.61 23.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.235 -0.893 . . . . 74.34 109.86 179.036 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.477 HD12 ' CE2' ' A' ' 216' ' ' PHE . 1.9 mp -106.6 147.08 12.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.001 0.429 . . . . 73.33 111.596 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.413 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.1 OUTLIER -77.1 167.17 38.89 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.902 -0.59 . . . . 74.12 110.61 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 194' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 27.8 Cg_endo -62.4 -29.49 79.32 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.464 2.11 . . . . 70.43 112.384 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -66.15 -38.89 89.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.261 -0.427 . . . . 71.15 111.143 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.445 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 18.8 m0 -96.88 36.9 1.35 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.357 -0.383 . . . . 70.43 111.027 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -158.66 -81.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 64.54 110.836 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -106.17 -71.39 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.972 0.415 . . . . 61.54 110.61 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 144.0 -176.0 23.55 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.756 -0.735 . . . . 50.24 112.743 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt -57.36 -35.26 69.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.866 0.365 . . . . 73.31 110.899 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -52.26 62.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 75.13 110.616 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.26 -143.68 15.73 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.878 -0.677 . . . . 74.12 112.559 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.411 ' HA ' ' HD2' ' A' ' 204' ' ' PRO . 0.8 OUTLIER -151.97 91.15 3.75 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.606 0.241 . . . . 63.14 110.595 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 204' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 203' ' ' GLN . 21.5 Cg_endo -61.28 -24.21 78.43 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.548 2.165 . . . . 71.52 112.636 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.69 -42.14 74.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.887 0.375 . . . . 73.15 110.862 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.823 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -99.63 26.69 5.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.031 -0.531 . . . . 63.15 111.325 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.53 32.26 13.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.374 -0.376 . . . . 75.35 111.149 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.589 HD12 HD21 ' A' ' 139' ' ' LEU . 19.1 mm -93.78 111.76 54.07 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 62.34 111.11 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 209' ' ' PRO . . . . . 0.588 ' HG2' ' HB2' ' A' ' 212' ' ' ALA . 53.6 Cg_endo -69.44 171.1 14.71 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.362 2.042 . . . . 63.51 112.217 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.33 120.75 7.92 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.492 2.128 . . . . 61.33 112.223 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 63.15 71.23 0.52 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 72.43 110.766 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 212' ' ' ALA . . . . . 0.588 ' HB2' ' HG2' ' A' ' 209' ' ' PRO . . . -123.09 129.06 50.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 54.05 111.432 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.5 tttt -65.43 139.4 58.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.022 -0.535 . . . . 75.33 110.723 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.87 109.6 15.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.416 -0.356 . . . . 74.32 111.318 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.751 HG23 ' HG2' ' A' ' 191' ' ' GLU . 61.2 m -107.88 141.83 38.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 61.53 110.643 179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.643 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 27.0 p90 -158.42 -178.83 7.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.066 0.46 . . . . 73.23 111.684 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 217' ' ' GLU . . . . . 0.404 ' HG2' ' CB ' ' A' ' 189' ' ' ARG . 3.0 mt-10 -136.86 140.37 42.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.746 -0.661 . . . . 72.4 110.601 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.718 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.4 t -123.93 152.23 29.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.108 0.48 . . . . 63.43 111.913 -178.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -136.64 109.78 7.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.635 -0.711 . . . . 74.32 110.289 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.819 HD23 ' SD ' ' A' ' 182' ' ' MET . 0.2 OUTLIER -69.8 128.7 37.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.401 -0.363 . . . . 62.11 110.776 -179.681 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.42 -32.51 2.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.21 -0.45 . . . . 72.45 111.516 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -169.37 159.78 8.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.866 0.365 . . . . 70.14 111.077 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.675 HD11 HD12 ' A' ' 220' ' ' LEU . 3.4 mp -140.83 110.31 3.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.046 -0.524 . . . . 72.15 111.077 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.421 . . . . 52.52 110.916 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.866 HG11 HG21 ' A' ' 136' ' ' THR . 48.4 t . . . . . 0 CA--C 1.528 0.12 0 CA-C-O 120.588 0.232 . . . . 35.11 110.642 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.453 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 87.1 Cg_endo -79.04 136.08 12.78 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.61 2.207 . . . . 45.41 112.582 -179.712 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -78.81 157.44 28.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 74.4 110.882 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.91 95.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 61.45 111.171 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.05 -18.0 63.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.489 . . . . 65.23 111.436 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.637 ' CE2' HD11 ' A' ' 20' ' ' LEU . 1.3 m-90 -137.2 173.74 11.36 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.94 0.4 . . . . 71.52 110.897 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.9 m -115.46 150.17 36.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.976 -0.556 . . . . 74.42 110.642 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.454 HG12 ' HD2' ' A' ' 16' ' ' ARG . 38.5 t -56.66 -31.79 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.917 0.389 . . . . 72.03 110.621 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -77.09 -25.56 52.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.968 -0.56 . . . . 72.21 111.042 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -82.21 -58.09 3.1 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.856 0.36 . . . . 75.33 110.833 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.772 ' HB3' HG22 ' A' ' 60' ' ' VAL . 2.6 mt -50.53 -61.08 2.4 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.196 -0.456 . . . . 63.02 111.004 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.568 ' HG3' HG11 ' A' ' 60' ' ' VAL . 22.3 mtt180 -54.16 -24.0 16.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.092 -0.504 . . . . 74.1 111.207 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.81 176.11 0.22 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.936 0.398 . . . . 60.52 111.115 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -110.3 16.65 21.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.022 -0.536 . . . . 71.52 111.161 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -106.9 -25.62 11.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.564 -0.289 . . . . 74.13 111.068 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.637 HD11 ' CE2' ' A' ' 10' ' ' TRP . 2.5 tt -88.05 112.69 50.95 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.413 -0.358 . . . . 42.42 110.957 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.37 125.46 18.99 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.433 2.088 . . . . 64.32 112.368 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.5 -24.12 66.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.162 -0.472 . . . . 75.22 111.156 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.498 ' HA ' HD12 ' A' ' 26' ' ' ILE . 0.6 OUTLIER -54.0 -40.01 66.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.393 -0.367 . . . . 72.24 111.343 -179.786 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.52 -56.79 5.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.219 -0.446 . . . . 72.02 111.063 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.9 mt -44.82 -31.37 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.88 -0.6 . . . . 75.42 111.446 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.647 HG12 HD21 ' A' ' 59' ' ' LEU . 7.7 mt -76.81 -38.8 30.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.931 0.396 . . . . 75.12 110.98 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -72.92 -24.67 60.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.988 -0.551 . . . . 74.01 111.075 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -71.46 -46.83 58.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.035 0.445 . . . . 74.12 110.812 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.813 HD21 ' HA ' ' A' ' 63' ' ' TYR . 6.4 mt -67.77 -25.03 65.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.838 -0.619 . . . . 72.33 110.994 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -78.55 -24.52 45.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.249 -0.432 . . . . 54.51 111.09 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 10.6 pt-20 -93.92 -41.29 9.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.808 0.337 . . . . 73.03 110.838 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.453 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 35.6 m170 -97.28 16.59 19.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 72.12 110.955 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.95 153.7 23.42 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.795 -0.717 . . . . 72.43 112.507 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.7 p -90.62 152.96 20.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.628 0.252 . . . . 40.04 110.507 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.657 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.1 p-10 -49.32 -57.05 7.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.691 0.281 . . . . 71.21 111.116 -179.828 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.8 t -47.95 -50.68 26.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.009 0.433 . . . . 65.14 110.685 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.458 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 9.0 t80 -53.56 -47.16 70.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.78 -0.646 . . . . 65.12 110.348 179.45 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.451 HD21 ' O ' ' A' ' 29' ' ' LEU . 12.9 mt -66.29 -41.04 90.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.047 -0.524 . . . . 74.12 110.722 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.802 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -48.26 -45.56 34.66 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.028 0.442 . . . . 73.21 110.943 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -58.43 -27.29 64.2 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.722 -0.672 . . . . 73.44 110.78 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -112.74 11.88 19.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.207 -0.451 . . . . 73.12 111.124 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.9 mptt 51.22 33.61 9.9 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.85 0.357 . . . . 44.44 110.907 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.785 HD13 HD13 ' A' ' 29' ' ' LEU . 46.7 mt -91.35 -22.62 20.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.104 -0.498 . . . . 73.24 111.802 -179.396 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.802 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -77.37 157.98 30.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.018 0.437 . . . . 63.23 111.123 -179.73 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.73 -121.21 5.1 Favored Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 115.807 -0.633 . . . . 62.11 112.446 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.867 ' O ' HG23 ' A' ' 50' ' ' VAL . 2.2 t-20 -116.32 116.29 27.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.746 0.308 . . . . 72.14 110.914 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.55 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.74 -55.83 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.24 -0.437 . . . . 63.02 111.413 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -47.61 -37.88 13.45 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.86 -0.609 . . . . 64.41 111.022 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -85.7 -26.08 26.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.022 -0.536 . . . . 65.41 111.089 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.867 HG23 ' O ' ' A' ' 46' ' ' ASN . 23.7 t -81.2 -25.8 10.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 63.21 111.418 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.1 -15.63 63.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.381 -0.372 . . . . 52.41 111.15 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -95.14 -32.96 12.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.235 -0.439 . . . . 73.54 110.86 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -87.94 -29.67 20.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.22 -0.446 . . . . 71.05 111.042 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -96.2 125.55 40.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.301 -0.409 . . . . 63.23 111.1 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -81.2 175.14 10.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 72.2 110.588 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.556 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -57.98 -58.25 9.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.855 0.36 . . . . 75.55 110.552 179.916 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.9 -26.46 68.61 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.075 -0.512 . . . . 65.51 110.584 179.578 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.0 -44.23 97.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.094 0.473 . . . . 74.25 110.441 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.647 HD21 HG12 ' A' ' 26' ' ' ILE . 19.2 mt -71.23 -33.68 70.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.635 -0.711 . . . . 75.45 111.046 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.772 HG22 ' HB3' ' A' ' 15' ' ' LEU . 16.4 t -77.38 -42.2 30.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.295 -0.411 . . . . 75.42 110.802 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.4 m -59.61 -34.6 72.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.866 -0.606 . . . . 73.35 110.634 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.485 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -81.96 -21.5 37.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 65.51 111.074 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.813 ' HA ' HD21 ' A' ' 29' ' ' LEU . 11.0 t80 -82.84 -22.89 33.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 74.32 111.029 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -84.37 -53.74 5.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.331 -0.395 . . . . 75.13 111.507 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.458 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.6 p-80 -61.08 -33.09 72.8 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.125 -0.489 . . . . 72.41 111.257 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.691 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.3 tt -47.64 -40.24 19.22 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.962 0.41 . . . . 71.44 111.258 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.406 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.7 m-85 -77.8 -39.02 45.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.029 -0.532 . . . . 75.43 110.679 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -36.28 81.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.92 -0.582 . . . . 63.24 110.988 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.5 p -93.64 -6.65 45.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 71.34 111.475 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.18 36.45 15.81 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.71 0.29 . . . . 72.13 111.186 179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -93.97 44.07 1.12 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.363 -0.381 . . . . 64.13 110.979 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.401 ' HA ' HD21 ' A' ' 66' ' ' LEU . 87.8 m-85 -65.48 174.65 2.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 74.44 110.822 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.2 tttt . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.274 -0.421 . . . . 63.13 110.906 179.901 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.095 0 CA-C-O 120.734 0.302 . . . . 75.04 110.959 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.485 ' CE2' ' HB2' ' A' ' 178' ' ' ALA . 8.0 p90 -154.34 147.9 25.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.278 -0.419 . . . . 64.31 110.882 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 70.7 m -118.01 103.55 10.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 71.02 110.893 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.61 151.46 21.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.331 -0.395 . . . . 70.43 111.117 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.2 m -143.93 124.96 14.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.114 -0.494 . . . . 73.43 110.761 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.601 ' O ' HG13 ' A' ' 115' ' ' VAL . 10.0 p -82.61 108.62 15.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.234 -0.439 . . . . 74.42 111.193 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -84.55 -47.86 10.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 75.32 110.784 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -117.63 107.9 14.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.177 -0.465 . . . . 73.35 110.949 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -62.15 134.35 56.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 65.21 110.917 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -104.52 -160.99 24.13 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.78 -0.724 . . . . 65.24 112.319 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -34.84 -47.33 0.34 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.917 0.389 . . . . 73.25 111.723 -179.411 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.533 ' O ' HG23 ' A' ' 122' ' ' THR . 0.8 OUTLIER 72.44 37.59 0.9 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.945 -0.57 . . . . 74.24 110.484 -179.764 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.533 HG23 ' O ' ' A' ' 121' ' ' LYS . 0.9 OUTLIER -162.08 -44.05 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.921 -0.581 . . . . 73.51 110.758 179.984 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -85.62 97.28 10.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 60.35 110.889 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -112.27 155.21 43.93 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.101 -0.499 . . . . 74.21 110.819 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.753 ' HB2' HG21 ' A' ' 166' ' ' VAL . 63.0 Cg_endo -73.84 125.52 10.0 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.529 2.152 . . . . 74.22 112.57 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -96.07 160.16 14.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.005 -0.543 . . . . 64.3 110.913 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.74 116.12 2.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.234 -0.439 . . . . 70.11 110.981 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' GLY . . . . . 0.403 ' O ' ' HG2' ' A' ' 165' ' ' LYS . . . 101.08 -28.28 16.74 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.743 -0.742 . . . . 64.43 112.239 -179.678 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.677 ' O ' HG22 ' A' ' 166' ' ' VAL . 3.9 m-20 -71.68 130.96 42.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.703 0.287 . . . . 73.15 110.4 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' ' 224' ' ' ASP . 12.4 m -73.59 176.17 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.072 0.463 . . . . 74.12 111.423 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.646 HG12 HG23 ' A' ' 223' ' ' ILE . 19.9 m -156.99 146.27 11.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.567 -0.742 . . . . 72.13 110.655 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.418 ' ND1' ' HB3' ' A' ' 163' ' ' SER . 0.5 OUTLIER -124.61 117.27 23.91 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.987 -0.285 . . . . 54.43 110.405 179.275 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.58 ' HB3' HD22 ' A' ' 220' ' ' LEU . 29.7 p -155.38 169.96 23.01 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.075 0.464 . . . . 61.51 111.411 -179.061 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.621 ' HB3' HD11 ' A' ' 149' ' ' ILE . 60.7 m95 -102.26 160.45 14.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.735 -0.666 . . . . 72.11 110.234 179.369 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.419 ' OH ' HD13 ' A' ' 162' ' ' LEU . 6.1 p90 -158.25 134.64 9.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.977 0.418 . . . . 71.21 111.59 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.866 HG21 HG11 ' A' ' 5' ' ' VAL . 84.8 m -124.84 108.83 12.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.616 . . . . 74.3 110.174 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.644 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -93.76 143.7 16.67 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.594 -0.812 . . . . 73.32 113.38 -179.205 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.565 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.7 OUTLIER -152.36 134.28 14.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.718 0.294 . . . . 52.42 110.574 179.669 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.438 HD23 HD23 ' A' ' 214' ' ' LEU . 52.9 mt -62.15 -179.73 0.24 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.425 -0.352 . . . . 72.42 110.672 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -54.74 -41.69 70.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.914 0.387 . . . . 64.3 110.836 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -80.68 0.35 34.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.016 -0.538 . . . . 64.03 111.488 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.19 25.85 27.66 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.644 -0.789 . . . . 42.12 112.542 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.8 m -80.77 108.34 14.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.828 0.347 . . . . 64.23 110.943 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 38.3 t -63.81 120.45 10.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 41.14 111.102 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.443 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 21.5 p90 -111.61 -24.43 10.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.222 -0.444 . . . . 70.25 111.104 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -162.18 112.63 1.56 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.799 0.333 . . . . 64.44 111.149 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.485 HG22 ' H ' ' A' ' 149' ' ' ILE . 43.5 m -127.01 113.28 16.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 72.54 110.696 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.51 ' C ' HD12 ' A' ' 149' ' ' ILE . 52.5 t30 -87.1 12.64 11.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 74.53 111.66 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.68 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.5 mp . . . . . 0 C--N 1.332 -0.184 0 CA-C-O 120.857 0.361 . . . . 75.21 111.003 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.529 ' HB1' ' HH2' ' A' ' 134' ' ' TRP . . . . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.79 0.329 . . . . 73.33 111.034 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.1 mttt -132.53 124.32 18.97 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 72.05 110.874 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 161' ' ' PRO . . . . . 0.401 ' HB2' ' HB3' ' A' ' 132' ' ' HIS . 50.4 Cg_exo -53.98 150.51 30.58 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.493 2.129 . . . . 71.43 112.294 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.419 HD13 ' OH ' ' A' ' 135' ' ' TYR . 0.5 OUTLIER -80.17 128.85 34.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.199 -0.455 . . . . 62.55 110.658 179.909 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.613 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 1.0 OUTLIER -109.45 127.3 54.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.322 -0.399 . . . . 65.55 111.313 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.587 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 25.3 p90 -152.82 143.5 22.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.066 -0.516 . . . . 74.23 110.829 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.603 ' CB ' HG21 ' A' ' 168' ' ' VAL . 2.2 mptt -71.02 132.34 45.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.337 -0.392 . . . . 62.03 110.9 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.753 HG21 ' HB2' ' A' ' 125' ' ' PRO . 33.7 m -87.68 149.26 4.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.142 -0.481 . . . . 64.51 111.06 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.74 24.46 75.47 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.792 -0.718 . . . . 44.4 112.64 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.603 HG21 ' CB ' ' A' ' 165' ' ' LYS . 14.4 m -134.03 46.42 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.845 0.355 . . . . 74.33 111.129 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.28 35.74 2.73 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 121.204 -0.522 . . . . 70.12 113.256 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 170' ' ' LYS . . . . . 0.58 ' HG2' HG23 ' A' ' 168' ' ' VAL . 12.3 mmtt -81.19 -47.03 13.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.897 0.38 . . . . 74.01 110.952 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 171' ' ' VAL . . . . . 0.41 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.3 OUTLIER -118.64 -179.09 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.992 -0.549 . . . . 64.23 110.879 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.57 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.4 pt -57.8 158.85 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.418 -0.355 . . . . 71.12 111.074 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 25.5 ttm105 -67.45 -27.15 66.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.235 -0.439 . . . . 63.23 111.273 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.58 -36.65 37.43 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.679 -0.772 . . . . 70.21 112.188 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.726 ' HE1' HG21 ' A' ' 218' ' ' VAL . 1.9 t90 -77.86 -33.68 52.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.954 0.407 . . . . 72.0 111.014 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -62.27 -41.54 98.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.964 -0.562 . . . . 72.53 110.308 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.94 -29.78 65.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.9 -0.591 . . . . 71.43 110.547 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.646 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -78.7 -61.65 1.94 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 71.41 111.246 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.717 HD21 ' NE1' ' A' ' 175' ' ' TRP . 15.1 mt -58.9 -20.44 51.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.978 -0.556 . . . . 73.41 111.23 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 4.1 mt -60.37 -27.21 67.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.774 0.321 . . . . 73.43 110.883 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 69.9 p -107.78 10.27 28.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 73.41 111.598 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.757 ' SD ' HD23 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -73.35 99.41 2.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.87 0.367 . . . . 63.14 110.848 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.17 161.46 19.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 75.32 111.169 -179.557 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 184' ' ' LYS . . . . . 0.439 ' HG3' HD12 ' A' ' 223' ' ' ILE . 10.8 tttt -59.88 114.99 3.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.827 -0.624 . . . . 72.41 111.227 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 81.3 8.62 86.97 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.961 -0.638 . . . . 72.33 113.126 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -85.4 139.7 31.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.028 0.442 . . . . 74.1 111.404 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -117.08 139.28 50.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.861 -0.609 . . . . 71.41 109.927 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -148.01 175.39 11.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 33.15 112.061 -179.497 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.63 121.39 17.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.41 -0.813 . . . . 65.12 109.56 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.646 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.5 pt? -134.36 143.42 47.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.346 0.593 . . . . 50.01 112.351 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.878 ' HG2' HG23 ' A' ' 215' ' ' THR . 4.2 mt-10 -114.87 117.42 30.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.135 -0.939 . . . . 71.44 109.945 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.499 HD12 ' CE2' ' A' ' 216' ' ' PHE . 2.2 mt -108.28 137.15 41.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.972 0.415 . . . . 71.02 111.495 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.63 164.94 45.89 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 70.35 110.57 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 194' ' ' PRO . . . . . 0.464 ' HG3' ' HA ' ' A' ' 211' ' ' ASN . 19.4 Cg_endo -59.03 -35.24 98.79 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.568 2.179 . . . . 54.45 112.226 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -56.54 -43.53 79.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 45.1 111.411 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.446 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 12.5 m0 -96.64 34.96 1.57 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.884 0.373 . . . . 63.02 111.169 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -159.38 -78.78 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.004 -0.544 . . . . 63.02 110.727 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 198' ' ' TYR . . . . . 0.578 ' CE2' HD13 ' A' ' 208' ' ' ILE . 47.1 m-85 -105.47 -71.28 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.0 0.429 . . . . 64.33 110.401 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.23 178.4 16.43 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.763 -0.732 . . . . 53.41 112.953 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -56.98 -31.7 65.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.811 0.339 . . . . 71.3 110.803 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -53.3 58.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.464 . . . . 75.23 110.609 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 107.61 -147.3 16.35 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.845 -0.693 . . . . 62.42 112.518 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.802 ' CB ' HD12 ' A' ' 208' ' ' ILE . 0.0 OUTLIER -156.61 82.9 3.29 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.779 0.323 . . . . 63.35 110.656 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -51.13 -35.7 52.66 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.749 2.3 . . . . 63.53 112.638 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.7 -42.1 83.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.855 0.359 . . . . 74.45 111.009 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.501 ' HB3' HG13 ' A' ' 208' ' ' ILE . . . -101.77 27.17 6.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.052 -0.522 . . . . 74.35 111.361 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 51.7 31.04 7.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.366 -0.379 . . . . 74.14 111.09 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.802 HD12 ' CB ' ' A' ' 203' ' ' GLN . 24.5 mt -89.17 111.71 46.77 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 51.23 111.181 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 209' ' ' PRO . . . . . 0.549 ' O ' ' HB2' ' A' ' 212' ' ' ALA . 70.6 Cg_endo -74.5 164.85 33.0 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.451 2.101 . . . . 71.32 112.397 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.99 147.89 50.36 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.651 2.234 . . . . 73.12 112.347 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 211' ' ' ASN . . . . . 0.464 ' HA ' ' HG3' ' A' ' 194' ' ' PRO . 70.7 m-80 51.13 36.22 15.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 73.12 111.03 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 212' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 209' ' ' PRO . . . -82.58 142.14 32.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 43.32 111.978 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -97.24 159.2 15.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.677 -0.692 . . . . 62.43 109.873 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.543 HD11 ' CD2' ' A' ' 198' ' ' TYR . 3.0 mt -134.39 108.99 8.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.988 0.423 . . . . 74.43 111.951 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.878 HG23 ' HG2' ' A' ' 191' ' ' GLU . 25.5 m -103.06 139.68 38.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.873 -0.603 . . . . 75.02 110.449 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.644 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 12.4 p90 -158.75 179.27 9.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.097 0.475 . . . . 70.11 111.894 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -136.67 140.32 42.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.543 -0.753 . . . . 71.14 110.593 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.726 HG21 ' HE1' ' A' ' 175' ' ' TRP . 4.4 t -124.12 151.8 29.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.087 0.47 . . . . 62.25 111.986 -178.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 219' ' ' GLU . . . . . 0.427 ' O ' ' HB2' ' A' ' 133' ' ' CYS . 25.4 tt0 -135.97 109.21 7.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.608 -0.724 . . . . 73.02 110.106 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.757 HD23 ' SD ' ' A' ' 182' ' ' MET . 0.2 OUTLIER -69.71 127.89 34.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.313 -0.403 . . . . 71.04 110.936 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 22.0 t -109.06 -29.46 2.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.167 -0.469 . . . . 63.13 111.33 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -169.59 160.34 8.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.412 -0.358 . . . . 64.25 110.916 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.646 HG23 HG12 ' A' ' 131' ' ' VAL . 3.4 mp -139.24 110.17 4.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 62.14 111.106 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 224' ' ' ASP . . . . . 0.563 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 73.04 110.892 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.957 HG11 HG21 ' A' ' 136' ' ' THR . 24.0 t . . . . . 0 CA--C 1.528 0.106 0 CA-C-O 120.58 0.229 . . . . 65.24 111.165 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.449 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.5 Cg_endo -78.4 137.61 15.02 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.608 2.206 . . . . 71.33 112.419 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.402 ' O ' ' N ' ' A' ' 9' ' ' ALA . 7.6 mm-40 -80.2 154.72 27.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.246 -0.433 . . . . 71.41 110.852 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.543 HH11 HD12 ' A' ' 149' ' ' ILE . 0.0 OUTLIER -52.34 89.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.107 -0.497 . . . . 72.45 111.373 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.402 ' N ' ' O ' ' A' ' 7' ' ' GLN . . . -60.69 -34.55 74.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 73.04 111.056 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.427 ' CE2' HD11 ' A' ' 20' ' ' LEU . 1.5 m-90 -116.09 173.74 6.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.489 . . . . 72.53 110.965 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.3 m -116.25 152.18 34.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.944 -0.571 . . . . 41.41 110.535 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.55 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.9 t -56.6 -33.64 40.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.912 0.386 . . . . 62.51 110.854 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -74.13 -25.7 59.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.989 -0.55 . . . . 74.21 111.181 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -82.12 -56.91 3.65 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.806 0.336 . . . . 73.44 110.994 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.69 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.2 mt -49.6 -63.73 1.02 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.258 -0.428 . . . . 61.33 111.116 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.552 ' HG3' HG11 ' A' ' 60' ' ' VAL . 22.5 mtt180 -53.92 -24.72 17.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.484 . . . . 73.43 111.187 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.17 178.23 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.034 0.445 . . . . 72.11 111.256 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -110.41 17.05 21.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.827 -0.624 . . . . 72.22 111.179 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.67 -24.89 11.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.588 -0.278 . . . . 73.44 111.231 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.523 HD22 HD11 ' A' ' 25' ' ' ILE . 6.2 tt -89.07 116.27 65.88 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.414 -0.357 . . . . 74.44 111.054 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.29 124.41 15.81 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.437 2.091 . . . . 60.33 112.235 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.458 ' O ' HD12 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -60.77 -24.18 65.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 64.14 111.206 -179.942 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -57.75 -32.97 67.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.388 -0.369 . . . . 73.24 111.335 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -78.87 -53.07 7.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.923 0.392 . . . . 62.14 111.133 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.673 ' O ' HD12 ' A' ' 29' ' ' LEU . 34.9 mt -46.54 -35.66 2.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.899 -0.592 . . . . 63.31 111.411 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.692 ' HB ' HG23 ' A' ' 47' ' ' ILE . 6.2 mt -75.74 -44.72 39.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 63.13 111.012 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.78 -25.18 64.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.01 -0.541 . . . . 72.35 110.925 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 38.3 t80 -70.05 -44.01 70.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 74.21 110.65 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.729 HD21 ' HA ' ' A' ' 63' ' ' TYR . 2.5 mt -71.32 -24.21 62.08 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.752 -0.658 . . . . 75.2 110.92 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -76.34 -25.15 54.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.282 -0.417 . . . . 71.23 110.803 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -102.35 -10.51 19.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.236 -0.438 . . . . 72.11 111.095 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 13.1 m170 -117.09 -11.43 10.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.425 -0.352 . . . . 72.22 111.371 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -120.3 164.69 13.8 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.679 -0.772 . . . . 34.43 112.391 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.77 149.58 21.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.599 0.238 . . . . 73.12 110.468 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.594 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -48.51 -57.15 6.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.79 0.328 . . . . 62.35 111.016 -179.82 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.3 p -47.89 -51.67 22.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.909 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.516 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 4.7 t80 -53.48 -46.85 70.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.835 -0.621 . . . . 62.02 110.387 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.512 HD22 ' HB3' ' A' ' 43' ' ' LEU . 13.2 mt -65.34 -41.47 93.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.0 -0.545 . . . . 71.04 110.744 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.852 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -48.11 -43.64 31.21 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.961 0.41 . . . . 54.21 111.034 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -58.87 -27.96 65.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.905 -0.589 . . . . 63.53 110.834 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 39.1 m-70 -112.75 10.28 19.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.155 -0.475 . . . . 71.32 111.169 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.4 mttp 55.24 36.98 28.2 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.89 0.376 . . . . 53.03 110.823 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.555 HD21 HD23 ' A' ' 59' ' ' LEU . 11.7 mt -94.97 -21.84 18.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.109 -0.496 . . . . 72.33 111.898 -179.32 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.852 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -77.24 155.51 32.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.12 0.486 . . . . 73.13 111.201 -179.756 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.27 -123.51 5.89 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.626 -0.715 . . . . 71.11 112.427 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.658 ' O ' HG23 ' A' ' 50' ' ' VAL . 2.4 m-80 -116.38 118.04 31.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.75 0.309 . . . . 61.42 110.986 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.692 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.1 mp -45.16 -52.22 2.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.167 -0.47 . . . . 53.35 111.401 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -47.34 -37.16 10.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.907 -0.588 . . . . 52.12 110.974 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -85.65 -25.67 26.45 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.921 -0.581 . . . . 73.24 111.205 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.658 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.5 t -83.45 -25.94 7.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.384 -0.371 . . . . 73.52 111.453 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.78 -17.93 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.441 -0.345 . . . . 61.54 111.406 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.6 pttp -95.09 -33.8 12.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.829 0.347 . . . . 73.42 110.995 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.5 m -87.38 -31.0 20.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.228 -0.442 . . . . 60.5 111.031 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.68 127.7 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 63.11 111.17 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -83.41 176.77 8.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 73.42 110.683 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.536 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -58.54 -58.25 9.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.869 0.366 . . . . 72.01 110.515 179.918 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.39 -29.49 70.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.141 -0.481 . . . . 74.54 110.308 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -42.22 98.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 74.41 110.435 179.645 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.555 HD23 HD21 ' A' ' 43' ' ' LEU . 71.8 mt -72.03 -35.75 69.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.734 -0.666 . . . . 72.22 110.87 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.69 HG22 ' HB3' ' A' ' 15' ' ' LEU . 17.3 t -75.57 -41.24 41.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.213 -0.449 . . . . 72.21 110.826 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.6 m -60.45 -34.0 73.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.895 -0.593 . . . . 52.44 110.428 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.426 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -80.7 -21.24 41.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 72.53 110.932 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.729 ' HA ' HD21 ' A' ' 29' ' ' LEU . 62.1 t80 -83.86 -22.95 31.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.077 -0.51 . . . . 74.44 111.017 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -84.89 -54.51 4.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.23 -0.441 . . . . 73.34 111.512 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.516 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.4 p-80 -61.31 -26.28 67.68 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.076 -0.511 . . . . 75.03 111.056 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.664 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.7 tt -53.08 -39.81 63.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.938 0.399 . . . . 54.24 110.976 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -78.23 -37.66 44.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.981 -0.554 . . . . 74.2 110.599 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.62 -36.51 78.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.974 -0.557 . . . . 64.13 110.818 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 46.6 p -88.9 -9.82 50.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.033 -0.531 . . . . 73.1 111.454 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 50.5 37.69 16.53 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.754 0.312 . . . . 64.25 111.234 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 37.1 mtt180 -100.3 47.54 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.286 -0.416 . . . . 64.05 110.975 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.434 ' CD2' ' HD2' ' A' ' 6' ' ' PRO . 75.1 m-85 -69.22 178.61 2.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.164 -0.471 . . . . 74.23 110.924 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 55.44 110.749 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.436 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.853 0.359 . . . . 74.43 110.936 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.511 ' CE2' ' HB2' ' A' ' 178' ' ' ALA . 41.4 p90 -151.59 155.08 37.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.273 -0.421 . . . . 61.23 110.931 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 71.5 m -122.88 103.5 8.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.161 -0.472 . . . . 71.21 110.845 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.508 ' CE ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -89.48 151.38 22.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.275 -0.421 . . . . 63.4 111.125 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.426 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.9 OUTLIER -144.89 112.83 6.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 54.25 110.837 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.508 HG22 ' CE ' ' A' ' 113' ' ' LYS . 19.5 t -81.94 106.36 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 72.24 111.29 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.556 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.0 mm? -83.21 -41.81 17.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 72.22 110.844 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 4.6 tptt -128.44 108.13 10.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 73.12 110.984 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -59.44 144.67 46.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 72.02 110.966 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.513 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -115.66 -156.55 11.03 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.721 -0.752 . . . . 52.5 112.642 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -35.84 -52.32 0.72 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.022 0.439 . . . . 62.33 111.576 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.9 tttp 69.9 33.47 2.82 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.834 -0.621 . . . . 64.11 110.325 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -152.33 -44.57 0.1 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.796 -0.638 . . . . 64.21 110.651 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' ASN . . . . . 0.401 ' HB2' ' HB2' ' A' ' 184' ' ' LYS . 13.7 m120 -91.01 98.41 11.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 74.31 110.841 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -108.08 157.16 36.91 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 71.42 110.913 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.636 ' HA ' HG21 ' A' ' 223' ' ' ILE . 58.7 Cg_endo -71.93 125.83 11.34 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.577 2.185 . . . . 63.24 112.407 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -96.88 155.08 16.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 74.44 110.889 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -62.69 117.12 5.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 70.42 110.861 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 104.78 -22.96 32.43 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.612 -0.804 . . . . 74.34 112.647 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -85.95 140.17 30.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.756 0.312 . . . . 65.2 110.818 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.698 HG12 ' HG3' ' A' ' 165' ' ' LYS . 22.2 m -69.09 173.24 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.971 0.415 . . . . 71.43 111.328 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.901 HG22 ' O ' ' A' ' 164' ' ' PHE . 15.9 m -156.89 145.77 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.717 -0.674 . . . . 62.53 110.588 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.461 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.95 117.89 22.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.659 0.266 . . . . 75.01 110.665 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.434 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 25.1 p -150.28 173.92 13.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.118 0.485 . . . . 71.32 111.407 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.842 ' HB3' HD11 ' A' ' 149' ' ' ILE . 87.5 m95 -108.25 157.58 18.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.552 -0.749 . . . . 72.35 110.057 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.478 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 40.3 p90 -162.23 138.37 7.67 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.223 0.535 . . . . 64.42 112.145 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.957 HG21 HG11 ' A' ' 5' ' ' VAL . 12.3 m -129.69 114.57 16.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.426 -0.806 . . . . 71.04 110.151 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.619 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.06 146.01 18.11 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.544 -0.836 . . . . 54.52 113.328 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.747 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -151.22 147.8 27.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.816 0.341 . . . . 73.2 110.766 179.711 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.484 ' HA ' HD23 ' A' ' 139' ' ' LEU . 12.6 mt -81.72 -177.18 6.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 63.3 110.851 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -59.66 -43.1 94.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.45 . . . . 74.02 110.885 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.04 -5.73 56.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.981 -0.554 . . . . 72.44 111.357 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 98.44 25.42 10.11 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.7 -0.762 . . . . 34.22 112.648 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.08 109.65 20.69 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.827 0.346 . . . . 71.01 110.761 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.498 HG12 HG23 ' A' ' 138' ' ' THR . 3.0 m -63.69 135.1 28.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.446 . . . . 63.32 111.296 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.437 ' CD1' ' N ' ' A' ' 146' ' ' ASP . 21.0 p90 -116.85 -40.99 3.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.094 -0.503 . . . . 53.24 110.643 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 146' ' ' ASP . . . . . 0.437 ' N ' ' CD1' ' A' ' 145' ' ' PHE . 70.6 m-20 -143.65 110.3 5.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.914 -0.584 . . . . 60.0 110.374 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.427 ' CG2' HG23 ' A' ' 136' ' ' THR . 25.0 m -134.1 107.72 7.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.941 0.401 . . . . 73.23 111.455 -179.462 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.478 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 27.8 t30 -90.32 44.3 1.19 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.958 -0.565 . . . . 70.14 110.21 179.281 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.842 HD11 ' HB3' ' A' ' 134' ' ' TRP . 35.5 mm . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 61.12 110.893 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.798 0.333 . . . . 50.04 111.075 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 13.5 mmtt -140.8 145.97 42.12 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 65.53 110.897 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -69.71 152.93 69.68 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.549 2.166 . . . . 51.42 112.31 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.442 HD23 ' HD1' ' A' ' 164' ' ' PHE . 2.0 tt -73.67 123.09 23.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 74.44 110.48 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.682 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.39 120.83 40.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.939 0.4 . . . . 75.43 111.266 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.901 ' O ' HG22 ' A' ' 131' ' ' VAL . 13.9 p90 -149.67 141.13 23.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.029 -0.532 . . . . 74.44 110.786 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.698 ' HG3' HG12 ' A' ' 130' ' ' VAL . 28.2 mtmt -77.34 138.17 39.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.958 0.409 . . . . 72.1 110.895 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.602 HG21 ' HB2' ' A' ' 125' ' ' PRO . 29.8 m -87.5 148.92 4.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.945 -0.57 . . . . 71.45 111.051 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 66.01 25.59 72.11 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.688 -0.768 . . . . 73.23 112.098 -179.5 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.56 HG21 ' HB3' ' A' ' 165' ' ' LYS . 1.9 t -130.98 40.98 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.843 0.354 . . . . 74.31 111.016 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.54 35.18 5.38 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 121.05 -0.595 . . . . 72.41 112.966 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.31 -47.05 11.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.906 0.384 . . . . 73.05 111.064 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.3 m -117.48 179.73 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.095 -0.502 . . . . 73.21 111.058 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.527 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -59.95 160.11 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.332 -0.394 . . . . 61.42 111.12 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -68.04 -28.89 67.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.264 -0.426 . . . . 74.01 111.193 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.83 -37.82 43.6 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.64 -0.79 . . . . 74.14 111.943 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.716 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.3 t90 -79.03 -34.06 44.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.043 0.449 . . . . 65.41 110.964 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 176' ' ' ASP . . . . . 0.645 ' O ' HD13 ' A' ' 180' ' ' LEU . 36.0 t70 -65.16 -31.16 72.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.756 -0.656 . . . . 74.12 110.602 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -82.0 -28.53 32.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 75.14 110.833 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.628 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -80.32 -62.01 1.81 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.226 -0.443 . . . . 61.31 111.168 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.675 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 6.4 mt -50.29 -32.56 17.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.972 -0.558 . . . . 65.51 110.824 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.645 HD13 ' O ' ' A' ' 176' ' ' ASP . 0.3 OUTLIER -54.54 -24.58 21.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.138 -0.483 . . . . 71.13 110.957 179.734 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 24.9 p -97.54 1.84 49.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.253 -0.431 . . . . 62.4 111.707 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.567 ' HE1' ' O ' ' A' ' 218' ' ' VAL . 0.0 OUTLIER -79.68 152.77 29.75 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.765 0.316 . . . . 64.41 110.565 179.773 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 10.3 p -120.94 173.07 7.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.977 0.418 . . . . 74.5 111.505 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 184' ' ' LYS . . . . . 0.596 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -64.61 117.4 7.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.808 -0.633 . . . . 74.05 110.574 179.721 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.43 66.46 2.24 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.614 -0.803 . . . . 44.14 112.085 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 186' ' ' GLU . . . . . 0.513 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 30.9 tt0 -145.05 144.4 30.96 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.623 0.249 . . . . 74.54 110.461 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -119.26 137.24 53.8 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.204 -0.295 . . . . 63.13 110.204 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -144.26 173.1 12.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.149 0.499 . . . . 75.03 111.865 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.57 101.14 4.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.527 -0.761 . . . . 52.44 109.752 179.413 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.807 HD12 HD11 ' A' ' 192' ' ' ILE . 1.0 OUTLIER -115.61 142.26 46.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.123 0.487 . . . . 64.44 111.947 -178.827 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.854 ' HB3' HG23 ' A' ' 215' ' ' THR . 4.8 pt-20 -114.14 119.28 36.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.651 -0.704 . . . . 74.25 110.207 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.807 HD11 HD12 ' A' ' 190' ' ' LEU . 1.8 mm -99.51 143.93 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.858 0.361 . . . . 65.23 111.262 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.42 165.4 46.54 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.075 -0.512 . . . . 71.41 110.602 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -64.51 -43.57 13.32 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.486 2.124 . . . . 72.14 112.264 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -54.67 -24.28 21.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 63.31 111.304 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.436 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 8.5 m0 -115.93 36.94 3.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.404 -0.362 . . . . 75.24 111.122 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -156.67 -81.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.259 -0.428 . . . . 61.42 111.363 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 198' ' ' TYR . . . . . 0.771 ' CE2' HD13 ' A' ' 208' ' ' ILE . 17.2 m-85 -104.76 -31.19 9.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.899 0.381 . . . . 70.23 110.937 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 107.25 168.42 22.09 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.747 -0.74 . . . . 52.13 112.575 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -30.62 67.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.846 0.355 . . . . 72.11 110.896 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 6.8 pttt -59.91 -48.12 83.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.245 -0.434 . . . . 71.52 110.754 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.68 161.78 24.08 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.801 -0.714 . . . . 74.32 112.467 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.783 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.3 OUTLIER -105.77 89.1 3.27 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 120.65 0.262 . . . . 74.52 110.809 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.37 -22.25 52.83 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.502 2.134 . . . . 64.51 112.369 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.3 -40.51 82.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.304 -0.407 . . . . 62.3 110.923 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -109.26 27.13 9.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 73.44 111.254 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 11.0 tttt 56.84 54.4 7.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.249 -0.432 . . . . 74.31 111.044 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.783 HD12 ' HB3' ' A' ' 203' ' ' GLN . 42.4 mt -118.36 111.68 38.13 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 74.42 111.125 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.37 172.54 1.86 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.516 2.144 . . . . 75.23 112.309 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.2 127.53 12.09 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.583 2.188 . . . . 71.13 112.332 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 30.3 m-20 63.9 71.23 0.49 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.277 -0.419 . . . . 62.43 110.852 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.84 128.59 49.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 54.43 111.248 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -65.59 141.37 58.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.477 . . . . 65.11 110.735 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.593 HD11 ' CE2' ' A' ' 198' ' ' TYR . 22.8 mt -121.79 109.61 14.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 74.23 111.117 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.854 HG23 ' HB3' ' A' ' 191' ' ' GLU . 0.2 OUTLIER -107.95 136.83 46.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.36 -0.382 . . . . 72.33 110.778 179.911 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.619 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 18.0 p90 -152.92 176.94 11.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.992 0.425 . . . . 74.5 111.268 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -130.92 135.0 47.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.843 -0.617 . . . . 75.22 110.31 179.383 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.716 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.6 t -120.24 150.13 22.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.076 0.465 . . . . 63.44 112.122 -178.654 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -136.75 107.63 6.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.617 -0.72 . . . . 75.41 110.192 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.596 HD22 ' HA ' ' A' ' 184' ' ' LYS . 3.0 tt -70.37 134.47 47.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.38 -0.373 . . . . 73.53 111.046 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.419 ' N ' HD23 ' A' ' 220' ' ' LEU . 20.9 t -111.3 -29.81 2.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.207 -0.451 . . . . 75.03 111.446 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 222' ' ' ASP . . . . . 0.477 ' N ' HD23 ' A' ' 220' ' ' LEU . 2.0 t0 -173.0 163.87 4.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.855 0.359 . . . . 71.2 111.112 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.682 HG23 HG12 ' A' ' 131' ' ' VAL . 2.7 mp -139.86 110.42 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 73.45 110.984 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 224' ' ' ASP . . . . . 0.559 ' O ' HG22 ' A' ' 130' ' ' VAL . 1.6 m-20 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 74.13 110.836 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 1.13 HG11 HG21 ' A' ' 136' ' ' THR . 34.9 t . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.636 0.255 . . . . 72.52 111.112 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.448 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.7 Cg_endo -78.42 142.54 18.75 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.615 2.21 . . . . 41.42 112.512 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.416 ' HB2' ' HB3' ' A' ' 217' ' ' GLU . 7.2 tp60 -83.84 153.48 24.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 71.42 110.833 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.17 110.45 0.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.184 -0.462 . . . . 70.34 111.327 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.56 -18.98 43.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.495 . . . . 64.21 111.2 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.582 ' CD1' HD11 ' A' ' 20' ' ' LEU . 1.4 m-90 -135.01 172.92 12.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.067 0.461 . . . . 62.05 110.761 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.4 m -110.2 148.58 31.56 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.731 -0.668 . . . . 53.15 110.103 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.48 ' O ' ' CG ' ' A' ' 16' ' ' ARG . 58.2 t -56.32 -33.58 38.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.96 0.41 . . . . 74.45 110.211 179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -69.92 -25.74 63.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.803 -0.635 . . . . 72.03 110.791 179.222 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.417 ' O ' ' HB2' ' A' ' 17' ' ' SER . 0.1 OUTLIER -82.02 -54.9 4.93 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.337 -0.392 . . . . 72.13 111.273 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.795 ' HB3' HG22 ' A' ' 60' ' ' VAL . 4.4 mt -50.0 -66.71 0.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.082 0.401 . . . . 51.5 112.082 -178.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.48 ' CG ' ' O ' ' A' ' 12' ' ' VAL . 1.8 ptm180 -61.59 -23.09 65.77 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 120.895 -0.322 . . . . 70.13 111.622 -178.932 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.417 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -54.61 178.57 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.739 0.304 . . . . 70.41 110.847 179.773 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -110.27 11.39 23.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.326 -0.397 . . . . 73.44 111.434 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -103.47 -26.18 12.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.765 0.317 . . . . 64.14 111.12 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.63 HD22 HD11 ' A' ' 25' ' ' ILE . 8.5 tt -87.53 130.72 46.24 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.348 -0.387 . . . . 74.11 110.91 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -74.25 127.92 11.65 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.505 2.137 . . . . 54.14 112.369 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -25.06 66.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 74.13 111.193 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.54 ' HA ' HD12 ' A' ' 26' ' ' ILE . 11.8 mmtp -54.08 -39.19 66.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.852 0.358 . . . . 72.34 111.351 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.43 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 0.8 OUTLIER -70.05 -58.35 3.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.198 -0.456 . . . . 74.51 111.093 -179.896 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.63 HD11 HD22 ' A' ' 20' ' ' LEU . 17.9 mt -44.7 -32.62 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.864 -0.607 . . . . 62.53 111.577 -179.566 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.643 HG12 HD21 ' A' ' 59' ' ' LEU . 8.1 mt -75.11 -37.2 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.363 -0.381 . . . . 74.14 111.008 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 mttm -72.43 -23.88 61.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.016 -0.538 . . . . 71.41 111.258 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -73.73 -45.88 49.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.967 0.413 . . . . 73.14 110.917 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.915 HD13 HD13 ' A' ' 43' ' ' LEU . 4.6 mt -67.89 -24.96 65.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.862 -0.608 . . . . 74.1 110.998 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -80.46 -27.86 37.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.35 -0.386 . . . . 74.01 110.98 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.42 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 15.7 pt-20 -94.01 -41.63 9.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.298 -0.41 . . . . 63.04 111.034 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.448 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 21.2 m170 -98.51 16.54 21.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.285 -0.416 . . . . 65.12 111.035 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.26 154.37 23.98 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.81 -0.71 . . . . 64.44 112.525 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.1 p -88.6 148.26 24.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.66 0.267 . . . . 72.45 110.653 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.584 ' HA ' HD12 ' A' ' 38' ' ' LEU . 0.5 OUTLIER -48.8 -57.12 6.87 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.784 0.325 . . . . 61.52 110.988 -179.874 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.5 t -48.03 -51.15 25.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.195 -0.457 . . . . 71.53 110.724 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.498 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 17.1 t80 -55.12 -45.55 75.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.759 -0.655 . . . . 75.24 110.16 179.286 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.656 HD21 ' O ' ' A' ' 29' ' ' LEU . 14.7 mt -63.47 -43.56 96.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.933 -0.576 . . . . 70.43 110.477 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.881 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.5 -34.26 7.29 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.13 -0.487 . . . . 62.12 110.575 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -50.55 -48.36 57.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.65 -0.704 . . . . 51.03 110.76 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -106.36 16.25 25.01 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.947 -0.57 . . . . 74.32 110.883 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.8 mttt 57.27 40.95 27.45 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.833 0.349 . . . . 75.15 110.952 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.915 HD13 HD13 ' A' ' 29' ' ' LEU . 51.0 mt -91.59 -25.38 19.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 34.03 111.597 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.881 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -69.79 158.34 35.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.017 0.437 . . . . 60.4 111.114 -179.761 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.19 -124.77 6.45 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.775 -0.648 . . . . 75.2 112.359 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.834 ' O ' HG23 ' A' ' 50' ' ' VAL . 3.4 m120 -116.39 122.57 45.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.794 0.33 . . . . 61.1 110.88 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.578 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -46.13 -49.4 5.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.219 -0.446 . . . . 73.11 111.29 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.5 mttt -50.75 -39.56 52.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.98 -0.555 . . . . 71.22 110.846 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -85.68 -26.28 26.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.869 -0.605 . . . . 73.3 110.934 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.834 HG23 ' O ' ' A' ' 46' ' ' ASN . 28.5 t -78.8 -25.85 13.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 75.12 111.284 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.56 -19.98 64.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.398 -0.364 . . . . 71.2 111.252 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.1 ptpt -95.06 -33.05 12.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.379 -0.373 . . . . 73.21 110.909 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.83 31.79 2.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 73.52 110.977 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -156.08 125.07 6.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 41.33 111.061 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -84.07 171.7 12.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 65.21 110.722 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.637 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.1 OUTLIER -55.71 -58.08 9.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.917 0.389 . . . . 74.54 110.556 179.915 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.3 -25.71 67.3 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.036 -0.529 . . . . 44.43 110.537 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -46.83 84.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 54.23 110.515 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.643 HD21 HG12 ' A' ' 26' ' ' ILE . 21.9 mt -72.15 -31.18 65.74 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.657 -0.702 . . . . 64.45 111.228 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.795 HG22 ' HB3' ' A' ' 15' ' ' LEU . 15.2 t -79.75 -42.82 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.974 0.416 . . . . 53.31 110.907 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 92.2 m -59.33 -38.02 79.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.941 -0.572 . . . . 73.25 110.774 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.418 ' HA ' ' ND1' ' A' ' 65' ' ' HIS . . . -80.89 -21.81 40.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.314 -0.403 . . . . 65.25 111.108 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.638 ' HA ' HD21 ' A' ' 29' ' ' LEU . 12.9 t80 -82.85 -22.87 33.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 54.43 110.986 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 31.8 m-20 -84.97 -53.62 5.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 45.45 111.583 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.498 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.2 p-80 -61.6 -30.3 70.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.134 -0.485 . . . . 75.23 111.364 -179.423 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.729 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.1 tt -50.21 -39.83 45.43 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.875 0.369 . . . . 72.03 111.101 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -78.8 -36.79 42.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.065 -0.516 . . . . 64.32 110.598 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.12 -38.16 81.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 73.23 110.843 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.8 p -92.73 -6.25 49.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.024 -0.535 . . . . 64.04 111.387 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt 51.55 36.53 17.28 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.768 0.318 . . . . 73.55 111.34 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 41.9 mtt-85 -93.48 44.18 1.13 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.34 -0.391 . . . . 72.21 111.026 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.498 ' HA ' HD21 ' A' ' 66' ' ' LEU . 85.3 m-85 -64.59 173.12 2.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.297 -0.41 . . . . 73.44 110.786 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 53.1 tttp . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.273 -0.422 . . . . 72.54 110.9 -179.996 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.47 ' CG ' ' CD1' ' A' ' 196' ' ' TRP . 8.4 mmtt . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.658 0.266 . . . . 55.13 111.043 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -132.62 151.16 52.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.904 0.383 . . . . 71.32 111.022 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 63.8 m -130.94 103.64 6.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.034 -0.53 . . . . 64.11 111.099 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -101.73 142.31 33.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.331 -0.395 . . . . 74.13 110.978 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.593 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.5 m -140.78 118.0 11.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.477 . . . . 45.0 110.76 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.415 HG12 ' N ' ' A' ' 116' ' ' LEU . 39.7 t -57.65 154.75 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 75.22 111.336 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.593 HD12 ' O ' ' A' ' 114' ' ' SER . 4.1 mp -132.8 -46.59 0.87 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.977 -0.556 . . . . 71.3 110.571 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.7 tttm -130.42 108.23 9.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.006 -0.543 . . . . 70.15 110.707 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 20.0 pttt -61.2 131.54 50.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 40.4 110.913 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -100.12 -106.06 2.76 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.713 -0.756 . . . . 74.1 112.345 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.44 -40.21 11.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.916 0.389 . . . . 75.43 110.733 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.9 mtmt 66.75 32.56 6.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.969 -0.56 . . . . 70.12 110.686 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 63.3 m -148.61 -45.14 0.15 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.06 -0.518 . . . . 71.23 110.947 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -91.24 122.24 33.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 54.51 111.0 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -129.07 147.55 65.33 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 75.11 110.88 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.454 ' HA ' HG21 ' A' ' 223' ' ' ILE . 52.6 Cg_exo -52.96 127.4 24.76 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.592 2.195 . . . . 61.41 112.472 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.2 140.66 32.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.182 -0.463 . . . . 74.55 110.777 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -51.88 113.71 1.08 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.242 -0.436 . . . . 72.21 111.172 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.89 -15.14 55.75 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.729 -0.748 . . . . 75.23 112.741 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -88.1 140.95 28.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.826 0.346 . . . . 74.31 111.028 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.588 HG12 ' O ' ' A' ' 224' ' ' ASP . 7.6 p -70.91 163.29 3.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.08 -0.509 . . . . 74.31 110.974 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.933 HG12 HG23 ' A' ' 223' ' ' ILE . 14.0 m -155.21 146.76 13.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 74.2 111.176 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.6 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -127.64 118.0 23.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.711 0.291 . . . . 65.12 110.751 179.705 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.425 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 28.1 p -149.04 166.59 28.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.035 0.445 . . . . 62.24 111.207 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.921 ' HB3' HD11 ' A' ' 149' ' ' ILE . 93.3 m95 -101.8 160.16 14.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.766 -0.652 . . . . 73.15 110.261 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.449 ' CE2' ' ND2' ' A' ' 148' ' ' ASN . 53.1 p90 -163.28 139.48 6.99 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.129 0.49 . . . . 75.21 112.1 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 136' ' ' THR . . . . . 1.13 HG21 HG11 ' A' ' 5' ' ' VAL . 6.9 m -131.22 116.04 17.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.575 -0.739 . . . . 74.42 110.108 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.572 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.65 144.61 17.34 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.661 -0.78 . . . . 43.24 113.443 -179.26 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.633 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -151.75 136.32 16.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.808 0.337 . . . . 74.43 110.411 179.717 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.53 HD21 HD12 ' A' ' 208' ' ' ILE . 31.3 mt -67.81 -178.34 0.94 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 63.24 110.979 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -56.59 -42.1 78.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 75.15 110.89 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.43 -2.48 35.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.976 -0.557 . . . . 74.13 111.504 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' GLY . . . . . 0.442 ' C ' HG22 ' A' ' 138' ' ' THR . . . 88.57 25.78 29.38 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.664 -0.779 . . . . 50.52 112.672 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 31.0 m -90.61 116.37 28.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.8 0.333 . . . . 72.44 110.816 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.438 HG22 HG23 ' A' ' 138' ' ' THR . 24.1 t -63.61 130.24 28.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 73.52 111.064 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.759 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 55.1 p90 -114.68 -31.06 6.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 63.0 111.106 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 146' ' ' ASP . . . . . 0.42 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 2.7 m-20 -168.1 117.5 0.77 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.385 -0.371 . . . . 71.41 111.072 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.552 ' OG1' HG23 ' A' ' 136' ' ' THR . 15.0 t -142.87 129.52 20.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 75.01 110.94 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.449 ' ND2' ' CE2' ' A' ' 135' ' ' TYR . 35.8 p-10 -92.54 50.08 1.56 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.262 -0.426 . . . . 64.35 110.373 179.544 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.921 HD11 ' HB3' ' A' ' 134' ' ' TRP . 19.2 mm . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.126 -0.488 . . . . 74.3 110.893 -179.734 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 120.837 0.351 . . . . 51.13 111.032 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -137.13 133.76 18.61 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 64.11 110.897 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 161' ' ' PRO . . . . . 0.413 ' HB2' ' HB3' ' A' ' 132' ' ' HIS . 34.5 Cg_exo -56.95 155.94 25.97 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.37 2.047 . . . . 63.25 112.204 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.442 ' O ' HD23 ' A' ' 162' ' ' LEU . 2.6 tt -77.96 119.67 21.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.452 . . . . 73.32 110.382 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.648 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -97.69 121.84 40.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.395 . . . . 75.14 111.384 -179.721 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.881 ' O ' HG22 ' A' ' 131' ' ' VAL . 10.8 p90 -150.36 142.67 24.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.995 -0.548 . . . . 63.45 110.597 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.49 ' HB3' HG21 ' A' ' 168' ' ' VAL . 7.2 mtpt -81.26 141.03 34.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.981 0.42 . . . . 65.04 111.028 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.448 HG11 ' CB ' ' A' ' 125' ' ' PRO . 27.0 m -87.44 149.18 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.837 -0.62 . . . . 52.32 111.138 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 66.91 26.28 73.2 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.792 -0.718 . . . . 34.3 112.269 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.49 HG21 ' HB3' ' A' ' 165' ' ' LYS . 2.0 t -131.18 41.19 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.831 0.348 . . . . 75.43 110.984 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.02 34.84 3.23 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 121.105 -0.569 . . . . 73.3 112.966 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.62 -45.8 13.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.885 0.374 . . . . 73.04 111.016 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.1 m -118.41 179.55 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.042 -0.526 . . . . 64.12 111.066 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.537 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -61.82 159.07 2.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.262 -0.426 . . . . 74.43 111.246 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -65.08 -30.16 71.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.158 -0.474 . . . . 72.51 111.292 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.8 -36.21 43.04 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.529 -0.843 . . . . 45.44 112.197 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.723 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.5 t90 -80.22 -36.06 35.3 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.914 0.388 . . . . 63.42 110.91 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -60.89 -36.4 79.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.993 -0.549 . . . . 75.4 110.37 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 177' ' ' GLU . . . . . 0.763 ' O ' HG23 ' A' ' 181' ' ' THR . 3.9 mm-40 -78.04 -29.04 49.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.957 -0.565 . . . . 71.02 110.627 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.654 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -77.71 -60.44 2.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.202 -0.453 . . . . 75.04 111.144 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.669 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 7.1 mt -55.54 -35.98 66.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.984 -0.553 . . . . 50.32 110.897 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.7 tp -62.11 -28.77 69.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.224 -0.444 . . . . 70.12 110.835 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 181' ' ' THR . . . . . 0.763 HG23 ' O ' ' A' ' 177' ' ' GLU . 37.0 p -89.32 -8.54 53.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 75.14 111.369 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 9.4 mmm -75.47 159.4 31.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.762 0.315 . . . . 75.24 110.829 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.91 166.78 10.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 73.23 111.079 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 184' ' ' LYS . . . . . 0.716 ' HA ' HD22 ' A' ' 220' ' ' LEU . 5.5 tttm -65.56 123.35 19.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 53.44 111.095 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 70.24 39.27 71.79 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.737 -0.744 . . . . 55.25 112.702 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -121.16 149.78 42.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.834 0.35 . . . . 71.41 110.999 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -116.53 139.29 50.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 63.33 110.226 179.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -147.79 175.84 10.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.058 0.456 . . . . 71.12 111.642 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.7 124.49 21.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.722 -0.672 . . . . 73.23 109.838 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.702 HD11 ' CD1' ' A' ' 175' ' ' TRP . 1.3 pt? -135.91 142.14 44.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.187 0.518 . . . . 74.33 112.152 -179.213 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.687 ' HG3' HG23 ' A' ' 215' ' ' THR . 0.6 OUTLIER -117.35 113.42 22.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.416 -0.811 . . . . 62.52 110.15 179.302 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.574 HG21 ' O ' ' A' ' 196' ' ' TRP . 4.6 mp -96.57 142.77 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.975 0.417 . . . . 55.42 111.458 -179.556 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -78.77 164.43 55.51 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 115.88 -0.6 . . . . 73.12 110.834 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.83 -41.43 75.53 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.661 2.241 . . . . 42.04 112.409 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -63.28 -39.0 93.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 71.03 111.162 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.574 ' O ' HG21 ' A' ' 192' ' ' ILE . 9.0 m0 -96.3 27.1 3.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.359 -0.382 . . . . 74.33 111.103 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -150.04 -81.84 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 34.3 110.792 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -104.25 -71.27 0.74 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.039 0.447 . . . . 74.21 110.444 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 145.83 -174.36 25.82 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.823 -0.703 . . . . 72.02 112.808 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -56.9 -40.96 77.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.826 0.346 . . . . 71.23 110.895 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.46 -52.01 65.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.126 -0.488 . . . . 73.52 110.592 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.1 -139.46 14.56 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.84 -0.695 . . . . 63.13 112.519 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.406 ' HA ' ' HD2' ' A' ' 204' ' ' PRO . 2.1 mm-40 -150.89 90.35 4.19 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 120.656 0.265 . . . . 64.42 110.621 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 204' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 203' ' ' GLN . 23.8 Cg_endo -61.86 -22.57 74.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.523 2.149 . . . . 72.11 112.668 -179.627 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.65 -42.18 64.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.86 0.362 . . . . 72.14 110.889 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.759 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -97.59 25.76 5.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.064 -0.516 . . . . 74.22 111.358 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 54.71 32.45 17.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.344 -0.389 . . . . 63.34 111.16 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.53 HD12 HD21 ' A' ' 139' ' ' LEU . 20.2 mm -95.72 111.79 56.96 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 73.44 111.118 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 209' ' ' PRO . . . . . 0.788 ' HG2' ' HB2' ' A' ' 212' ' ' ALA . 39.9 Cg_endo -67.23 171.46 11.48 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.34 2.027 . . . . 75.1 112.171 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -68.72 122.17 9.1 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.535 2.157 . . . . 53.44 112.314 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 71.42 34.47 1.7 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.214 -0.448 . . . . 75.04 110.988 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 212' ' ' ALA . . . . . 0.788 ' HB2' ' HG2' ' A' ' 209' ' ' PRO . . . -83.86 147.38 27.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.046 0.45 . . . . 65.31 111.768 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 213' ' ' LYS . . . . . 0.453 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.1 OUTLIER -88.62 148.05 24.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.776 -0.647 . . . . 53.02 110.367 179.473 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.453 HD23 ' O ' ' A' ' 213' ' ' LYS . 5.5 mt -130.03 109.11 10.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.883 0.373 . . . . 63.54 111.767 -179.592 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.687 HG23 ' HG3' ' A' ' 191' ' ' GLU . 50.3 m -111.3 141.45 44.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.109 -0.496 . . . . 70.13 110.612 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.572 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 11.6 p90 -153.96 178.17 10.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.107 0.48 . . . . 70.23 111.717 -179.74 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 217' ' ' GLU . . . . . 0.462 ' OE2' HD22 ' A' ' 116' ' ' LEU . 1.4 mt-10 -127.9 132.13 49.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.604 -0.725 . . . . 63.3 110.123 179.409 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.723 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.4 t -120.8 149.04 23.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.121 0.486 . . . . 64.45 112.034 -178.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -136.73 109.85 7.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.584 -0.734 . . . . 75.14 110.253 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.778 HD21 HG13 ' A' ' 223' ' ' ILE . 3.2 tt -69.92 134.33 48.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.342 -0.39 . . . . 71.14 110.89 -179.646 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.441 ' N ' HD23 ' A' ' 220' ' ' LEU . 40.4 t -112.08 -29.96 2.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.252 -0.431 . . . . 50.14 111.392 -179.745 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 222' ' ' ASP . . . . . 0.455 ' N ' HD23 ' A' ' 220' ' ' LEU . 13.4 t70 -168.82 158.71 9.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.821 0.343 . . . . 62.31 111.176 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.933 HG23 HG12 ' A' ' 131' ' ' VAL . 35.1 mt -141.62 111.53 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 72.53 111.168 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 224' ' ' ASP . . . . . 0.588 ' O ' HG12 ' A' ' 130' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 75.31 110.841 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.511 HG23 ' OG1' ' A' ' 138' ' ' THR . 60.5 t . . . . . 0 CA--C 1.53 0.19 0 CA-C-O 120.636 0.255 . . . . 71.21 111.086 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.414 ' HD2' ' CE1' ' A' ' 72' ' ' PHE . 90.2 Cg_endo -80.7 146.15 16.59 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.813 2.342 . . . . 62.31 112.469 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.458 ' OE1' HD11 ' A' ' 149' ' ' ILE . 3.2 tp-100 -84.34 152.21 24.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 75.22 110.743 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 mpp_? -52.4 121.31 6.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 65.03 111.116 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -93.78 -13.05 27.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 72.22 111.376 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.631 ' NE1' HD11 ' A' ' 20' ' ' LEU . 1.2 m-90 -137.12 173.73 11.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.877 0.37 . . . . 74.24 110.681 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 m -117.11 151.36 36.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.06 -0.518 . . . . 70.33 110.58 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.522 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.4 t -57.18 -33.17 42.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.065 0.46 . . . . 65.03 110.364 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.53 -28.25 61.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.696 -0.684 . . . . 74.44 111.058 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -82.06 -57.75 3.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.323 -0.399 . . . . 74.41 110.994 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.756 ' HB3' HG22 ' A' ' 60' ' ' VAL . 2.5 mt -50.32 -62.24 1.7 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.198 -0.456 . . . . 64.43 111.092 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.531 ' HG3' HG11 ' A' ' 60' ' ' VAL . 26.0 mtt180 -54.37 -24.35 19.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 65.3 111.268 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.98 173.69 0.31 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.334 -0.394 . . . . 45.51 111.082 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.32 16.35 21.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 64.43 111.237 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -107.73 -25.32 11.33 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.547 -0.297 . . . . 74.42 111.011 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.941 HD22 HD11 ' A' ' 25' ' ' ILE . 10.3 tt -86.13 129.48 53.69 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.293 -0.412 . . . . 73.21 110.874 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.29 123.14 9.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.332 2.021 . . . . 43.34 112.32 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -24.06 66.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 74.24 111.211 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.9 mmtp -53.38 -39.31 64.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.396 -0.365 . . . . 61.44 111.396 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -79.02 -29.04 43.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.324 -0.398 . . . . 73.4 111.209 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.941 HD11 HD22 ' A' ' 20' ' ' LEU . 49.0 mt -66.18 -37.12 79.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.32 -0.4 . . . . 55.1 111.096 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.702 HG12 HD21 ' A' ' 59' ' ' LEU . 10.3 mt -72.53 -44.47 61.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 73.11 110.938 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.417 ' HG3' HD11 ' A' ' 47' ' ' ILE . 1.2 mtpt -59.53 -24.17 63.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.847 -0.615 . . . . 71.32 111.026 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -74.87 -50.08 18.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 73.21 110.894 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.898 HD23 HD12 ' A' ' 66' ' ' LEU . 5.1 mt -65.13 -40.69 94.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.963 -0.562 . . . . 70.53 110.919 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -67.89 -23.73 65.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.219 -0.446 . . . . 41.04 110.492 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -88.03 -48.21 7.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.086 -0.506 . . . . 75.55 110.885 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -97.23 16.44 19.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 63.05 111.307 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -131.34 151.93 19.86 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.661 -0.781 . . . . 62.1 112.408 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.83 154.05 19.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.685 0.279 . . . . 73.04 110.618 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.541 ' O ' HD21 ' A' ' 44' ' ' LEU . 0.7 OUTLIER -46.98 -52.67 14.14 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.527 -0.306 . . . . 55.14 111.337 -179.806 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 57.8 m -53.01 -46.54 68.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.012 0.434 . . . . 42.01 110.68 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.455 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 11.2 t80 -56.6 -48.25 77.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.785 -0.643 . . . . 54.31 110.726 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.718 HD22 ' HB3' ' A' ' 43' ' ' LEU . 13.4 mt -63.46 -45.2 91.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 74.3 110.889 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.929 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -48.07 -34.01 8.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 71.2 111.155 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -59.22 -55.39 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.996 -0.547 . . . . 55.11 111.025 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 -95.59 15.29 20.25 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.175 -0.466 . . . . 75.11 111.411 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 mttp 60.08 38.24 20.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.736 0.303 . . . . 71.22 111.182 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.718 ' HB3' HD22 ' A' ' 38' ' ' LEU . 14.3 mt -85.12 -21.76 29.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.373 -0.376 . . . . 62.3 110.796 179.637 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.929 HD11 ' HB2' ' A' ' 39' ' ' ALA . 81.2 mt -47.08 170.82 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.175 -0.466 . . . . 63.31 111.344 179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.71 -148.95 20.2 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.913 -0.661 . . . . 52.32 112.869 179.471 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.824 ' O ' HG23 ' A' ' 50' ' ' VAL . 4.6 m-20 -114.85 149.16 37.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.005 0.431 . . . . 73.52 111.16 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.699 HG23 HD12 ' A' ' 26' ' ' ILE . 3.4 mp -45.62 -42.03 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.847 -0.615 . . . . 55.31 111.599 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.21 -43.45 82.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.961 -0.563 . . . . 75.13 111.198 -179.838 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -85.71 -27.1 25.51 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.076 -0.511 . . . . 74.45 111.292 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 46' ' ' ASN . 35.3 t -76.74 -26.2 16.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.386 -0.37 . . . . 73.13 111.441 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.78 -25.39 65.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.442 -0.344 . . . . 33.2 111.366 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.29 -30.54 13.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 73.44 111.103 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -84.05 -19.76 33.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.264 -0.426 . . . . 42.52 111.471 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -117.74 130.13 56.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.865 0.364 . . . . 74.51 111.32 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -78.65 -179.09 6.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 73.01 110.48 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.571 ' O ' HG23 ' A' ' 60' ' ' VAL . 2.5 tpmp? -61.4 -58.45 8.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.796 0.332 . . . . 73.13 110.524 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -25.51 67.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.196 -0.456 . . . . 75.44 110.646 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.04 -40.06 94.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.11 0.481 . . . . 73.25 110.214 179.693 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.702 HD21 HG12 ' A' ' 26' ' ' ILE . 15.3 mt -77.07 -30.14 55.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.619 -0.719 . . . . 73.22 111.013 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.756 HG22 ' HB3' ' A' ' 15' ' ' LEU . 17.3 t -79.66 -43.48 23.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.991 0.424 . . . . 75.32 110.737 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 63.7 m -59.32 -34.8 72.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.945 -0.571 . . . . 61.5 110.448 179.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.446 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -82.64 -21.19 35.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.544 . . . . 72.01 110.997 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.78 ' HA ' HD21 ' A' ' 29' ' ' LEU . 14.2 t80 -83.63 -22.64 32.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.094 -0.503 . . . . 74.43 110.918 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 30.2 m-20 -85.06 -53.88 4.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 73.44 111.401 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.428 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.8 p-80 -62.33 -27.27 68.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.097 -0.501 . . . . 73.44 111.323 -179.405 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.898 HD12 HD23 ' A' ' 29' ' ' LEU . 3.8 tt -50.82 -40.79 56.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.899 0.38 . . . . 63.3 111.065 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.405 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.6 m-85 -79.05 -40.06 32.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.035 -0.53 . . . . 74.02 110.679 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -64.88 -39.75 94.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.961 -0.563 . . . . 74.32 110.972 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.2 p -88.98 -10.38 47.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.001 -0.545 . . . . 61.23 111.399 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt 53.55 33.21 15.77 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.683 0.277 . . . . 60.32 111.21 179.804 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -92.42 45.84 1.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 75.32 111.026 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.476 ' CE1' HD22 ' A' ' 66' ' ' LEU . 94.5 m-85 -64.86 171.87 3.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 62.4 110.801 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 33.9 tttt . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.325 -0.398 . . . . 73.31 110.914 179.975 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.442 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.768 0.318 . . . . 73.41 111.048 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.476 ' CE1' ' HB2' ' A' ' 178' ' ' ALA . 29.5 p90 -152.64 151.61 30.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.295 -0.412 . . . . 73.33 110.848 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 74.1 m -122.14 103.54 8.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 72.04 110.857 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.9 ttpt -95.92 145.52 25.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.328 -0.397 . . . . 73.1 111.11 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.428 ' O ' HD22 ' A' ' 116' ' ' LEU . 1.7 m -138.35 117.78 12.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 34.45 110.727 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 22.8 t -81.07 106.36 12.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.294 -0.412 . . . . 44.34 111.267 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.533 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -82.23 -42.0 19.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 74.32 110.67 179.761 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -125.05 107.72 11.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 53.4 110.927 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.1 mtmp? -63.64 139.29 58.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 62.35 110.953 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -112.67 -155.02 12.09 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.779 -0.724 . . . . 64.22 112.279 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -33.59 -50.46 0.34 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.917 0.389 . . . . 62.35 111.705 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.1 tttt 71.65 35.64 1.39 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.028 -0.533 . . . . 63.32 110.177 -179.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 75.0 m -163.62 -43.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.664 -0.698 . . . . 71.34 110.525 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -85.3 88.63 7.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.048 -0.524 . . . . 65.02 110.713 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -104.6 155.14 37.85 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 72.41 110.763 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.643 ' HB2' HG21 ' A' ' 166' ' ' VAL . 51.6 Cg_endo -69.49 125.55 12.41 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.433 2.089 . . . . 54.22 112.436 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -95.46 152.29 18.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.007 -0.542 . . . . 63.52 110.9 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.99 116.95 3.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.278 -0.419 . . . . 51.23 110.981 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 100.59 -26.99 22.52 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.73 -0.748 . . . . 75.33 112.519 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -73.13 137.62 45.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.835 0.35 . . . . 53.12 110.905 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.679 HG23 ' HG3' ' A' ' 165' ' ' LYS . 1.2 t -71.16 163.65 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 74.14 110.944 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.728 HG22 ' O ' ' A' ' 164' ' ' PHE . 2.8 m -153.77 145.27 14.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.038 -0.528 . . . . 73.13 110.884 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.449 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.3 OUTLIER -127.18 117.72 22.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.708 0.289 . . . . 75.13 110.658 179.591 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.738 ' HB3' HD22 ' A' ' 220' ' ' LEU . 28.4 p -153.23 167.64 28.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.965 0.412 . . . . 52.23 111.15 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.629 ' O ' HG13 ' A' ' 218' ' ' VAL . 8.4 m95 -102.64 162.98 12.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.928 -0.578 . . . . 73.22 110.067 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.673 ' CE1' HD13 ' A' ' 162' ' ' LEU . 46.3 p90 -162.3 138.4 7.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.078 0.466 . . . . 74.34 111.667 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.85 HG23 ' OG1' ' A' ' 147' ' ' THR . 0.2 OUTLIER -127.49 112.64 15.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.674 -0.694 . . . . 63.4 110.477 179.674 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.608 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.5 143.7 16.87 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.619 -0.801 . . . . 60.02 113.001 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.621 HG23 ' CG1' ' A' ' 144' ' ' VAL . 0.1 OUTLIER -151.47 139.01 19.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.758 0.313 . . . . 73.54 110.539 179.653 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.744 HD21 HG23 ' A' ' 208' ' ' ILE . 70.8 mt -72.0 -178.58 2.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.288 -0.415 . . . . 63.33 111.031 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -58.3 -42.32 86.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 71.24 110.752 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.87 -4.41 40.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.927 -0.579 . . . . 73.04 111.418 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' GLY . . . . . 0.583 ' C ' HG22 ' A' ' 138' ' ' THR . . . 90.68 21.73 36.04 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.674 -0.774 . . . . 72.14 112.726 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -90.66 109.12 20.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.8 0.333 . . . . 51.02 110.686 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.621 ' CG1' HG23 ' A' ' 138' ' ' THR . 3.1 m -63.58 139.93 20.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 44.32 111.165 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 33.7 p90 -118.85 -40.53 2.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.055 -0.52 . . . . 64.04 111.071 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -155.17 119.98 4.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.074 -0.512 . . . . 61.54 110.727 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.85 ' OG1' HG23 ' A' ' 136' ' ' THR . 3.5 t -142.82 129.39 20.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.279 -0.419 . . . . 73.44 111.327 -179.831 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.483 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 26.5 t-20 -93.62 46.65 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 72.41 110.435 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.551 HD13 ' HB3' ' A' ' 134' ' ' TRP . 17.6 mm . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 115.923 -0.581 . . . . 62.21 110.905 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.616 ' HB1' ' HH2' ' A' ' 134' ' ' TRP . . . . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.807 0.337 . . . . 50.41 111.129 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 5.7 tttm -138.69 120.36 10.26 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 74.21 110.863 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 161' ' ' PRO . . . . . 0.418 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 43.7 Cg_exo -56.33 150.96 47.11 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.378 2.052 . . . . 64.03 112.28 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.673 HD13 ' CE1' ' A' ' 135' ' ' TYR . 5.5 tt -74.17 121.73 21.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 63.03 110.563 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.563 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.1 OUTLIER -99.29 120.36 39.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.94 0.4 . . . . 72.23 111.11 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.728 ' O ' HG22 ' A' ' 131' ' ' VAL . 6.4 p90 -148.47 140.66 24.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.045 -0.525 . . . . 65.53 110.455 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.679 ' HG3' HG23 ' A' ' 130' ' ' VAL . 82.3 mttt -80.19 139.1 36.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.066 0.46 . . . . 74.22 111.192 -179.681 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.643 HG21 ' HB2' ' A' ' 125' ' ' PRO . 34.8 m -87.77 149.17 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.738 -0.664 . . . . 73.13 111.16 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.53 21.92 78.68 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.831 -0.7 . . . . 65.0 112.822 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.751 HG23 ' HG3' ' A' ' 170' ' ' LYS . 16.0 m -128.0 41.68 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.881 0.372 . . . . 74.21 111.18 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 41.21 38.19 1.8 Allowed Glycine 0 C--N 1.332 0.356 0 CA-C-N 115.975 -0.557 . . . . 71.15 113.403 179.517 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 170' ' ' LYS . . . . . 0.751 ' HG3' HG23 ' A' ' 168' ' ' VAL . 6.8 mtpp -87.38 -39.95 14.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.807 0.337 . . . . 44.42 111.077 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.5 m -119.03 177.13 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.205 -0.452 . . . . 75.12 110.925 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.531 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.42 158.6 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.339 -0.391 . . . . 73.13 111.331 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -67.34 -26.75 66.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.096 -0.502 . . . . 65.12 111.072 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.46 -37.07 36.77 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.615 -0.802 . . . . 73.12 112.087 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.668 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.5 t90 -78.2 -33.72 49.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.965 0.412 . . . . 75.32 111.044 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 176' ' ' ASP . . . . . 0.484 ' O ' HD13 ' A' ' 180' ' ' LEU . 4.3 t70 -64.65 -36.56 84.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.99 -0.55 . . . . 74.11 110.525 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -75.5 -29.58 59.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.025 -0.534 . . . . 73.4 110.648 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.672 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -81.46 -46.5 14.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 63.13 111.125 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.577 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 10.6 mt -70.67 -18.97 62.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.977 -0.556 . . . . 73.24 111.117 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.484 HD13 ' O ' ' A' ' 176' ' ' ASP . 2.2 tp -55.31 -23.06 21.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.453 -0.34 . . . . 72.13 111.453 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 27.0 p -115.95 19.92 14.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.588 -0.278 . . . . 71.03 111.565 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 2.2 mmt -66.17 108.15 2.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.843 0.354 . . . . 71.43 110.89 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.78 145.23 43.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 73.53 110.853 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.67 115.53 2.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 73.3 111.191 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 76.61 21.88 73.8 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.967 -0.635 . . . . 73.33 113.002 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -98.38 144.56 27.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.875 0.369 . . . . 71.33 111.201 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 10.6 ttpt -117.1 139.09 51.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.04 -0.527 . . . . 73.22 110.077 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.64 174.34 11.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.177 0.513 . . . . 62.11 112.0 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.54 107.35 6.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.478 -0.783 . . . . 74.31 109.701 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.672 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.0 OUTLIER -120.16 142.06 49.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.184 0.516 . . . . 63.03 112.105 -178.855 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.629 ' HG3' HG23 ' A' ' 215' ' ' THR . 0.3 OUTLIER -114.32 119.72 37.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.54 -0.755 . . . . 73.11 110.112 179.272 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.521 ' N ' HD13 ' A' ' 192' ' ' ILE . 0.9 OUTLIER -98.26 151.29 4.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.911 0.386 . . . . 74.31 111.173 -179.593 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -86.76 165.14 34.0 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.518 . . . . 63.31 110.715 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -62.12 -42.19 31.0 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.492 2.128 . . . . 73.12 112.246 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -59.0 -39.0 80.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.265 -0.425 . . . . 63.14 111.066 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.442 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 8.9 m0 -97.6 36.94 1.43 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.324 -0.398 . . . . 65.21 110.985 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -162.75 -77.55 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.444 . . . . 44.1 110.749 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 198' ' ' TYR . . . . . 0.746 ' CE2' HD13 ' A' ' 208' ' ' ILE . 23.0 m-85 -105.12 -71.22 0.75 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 72.0 110.516 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.21 175.46 14.1 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.873 -0.68 . . . . 62.4 112.845 179.614 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -26.38 63.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.782 0.325 . . . . 74.44 110.983 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -67.43 -52.61 37.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.976 0.417 . . . . 71.22 110.776 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 102.33 168.33 26.79 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.87 -0.681 . . . . 73.51 112.515 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.509 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.5 OUTLIER -107.43 91.63 7.26 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.657 0.265 . . . . 73.11 110.791 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -66.95 -21.03 50.51 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.462 2.108 . . . . 61.35 112.477 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.05 -42.05 98.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.873 0.368 . . . . 72.21 110.949 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -105.92 31.18 5.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.102 -0.499 . . . . 72.32 111.15 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 30.9 mttt 54.33 28.28 9.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 74.02 111.039 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.746 HD13 ' CE2' ' A' ' 198' ' ' TYR . 60.1 mt -89.07 113.55 56.64 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 73.41 110.966 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.26 171.5 11.45 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.447 2.098 . . . . 52.44 112.458 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.44 152.62 70.99 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.606 2.204 . . . . 74.51 112.378 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 46.4 32.14 1.48 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.19 -0.459 . . . . 74.41 111.228 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -79.9 144.29 33.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 63.51 111.483 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 213' ' ' LYS . . . . . 0.619 ' O ' HD23 ' A' ' 214' ' ' LEU . 18.5 tttt -89.55 144.72 25.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.938 -0.574 . . . . 74.31 110.258 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.631 HD11 ' CE2' ' A' ' 198' ' ' TYR . 8.0 mt -127.0 108.88 11.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.876 0.369 . . . . 62.41 111.7 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.629 HG23 ' HG3' ' A' ' 191' ' ' GLU . 56.2 m -109.67 143.18 39.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 52.43 110.501 179.585 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.608 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 15.0 p90 -156.05 178.38 10.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.108 0.48 . . . . 65.22 111.336 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -134.3 137.71 44.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.667 -0.697 . . . . 71.32 110.314 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.668 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.1 t -123.71 151.95 28.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.018 0.437 . . . . 73.04 111.876 -178.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -136.74 110.42 8.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.793 -0.639 . . . . 74.45 110.27 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.738 HD22 ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.47 132.81 46.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.426 -0.352 . . . . 74.44 110.758 -179.584 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.499 HG21 ' HE1' ' A' ' 134' ' ' TRP . 20.6 t -111.11 -31.45 2.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.279 -0.419 . . . . 64.42 111.469 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -170.66 161.97 7.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.904 0.383 . . . . 63.13 110.983 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.546 HG23 HG12 ' A' ' 131' ' ' VAL . 4.2 mp -139.48 109.61 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 72.55 111.058 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 75.0 110.906 179.977 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.849 HG11 HG21 ' A' ' 136' ' ' THR . 57.3 t . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.607 0.241 . . . . 65.11 111.062 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.457 ' HA ' ' HG2' ' A' ' 217' ' ' GLU . 98.3 Cg_endo -85.92 149.78 9.65 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 123.007 2.471 . . . . 71.13 112.552 -179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.443 ' NE2' HD11 ' A' ' 149' ' ' ILE . 0.8 OUTLIER -84.43 147.2 27.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 43.21 110.972 -179.953 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.28 99.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 73.31 111.234 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.42 -18.35 61.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 51.34 111.268 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.431 ' CH2' ' HB3' ' A' ' 24' ' ' ASP . 2.2 m-90 -131.81 173.35 11.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.865 0.364 . . . . 71.04 110.737 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.74 153.64 27.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.108 -0.496 . . . . 74.44 110.452 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.613 HG12 ' HD2' ' A' ' 16' ' ' ARG . 33.6 t -54.75 -35.01 31.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.983 0.42 . . . . 75.45 110.817 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.44 -34.32 78.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.985 -0.552 . . . . 64.12 111.069 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.457 ' HG2' HD12 ' A' ' 20' ' ' LEU . 0.8 OUTLIER -78.5 -55.43 5.22 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.798 0.332 . . . . 73.24 111.044 -179.902 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.709 ' HB3' HG22 ' A' ' 60' ' ' VAL . 8.2 mt -50.7 -30.76 14.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.993 0.425 . . . . 74.04 110.855 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.613 ' HD2' HG12 ' A' ' 12' ' ' VAL . 47.7 mtt180 -90.95 -28.77 17.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.829 -0.623 . . . . 75.31 110.397 179.421 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 31.0 t -49.37 176.0 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.901 -0.591 . . . . 74.24 111.484 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -110.37 17.41 20.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.746 -0.661 . . . . 74.41 111.234 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -117.67 -16.45 10.06 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.63 -0.259 . . . . 75.51 111.495 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.457 HD12 ' HG2' ' A' ' 14' ' ' GLN . 2.1 tt -87.72 112.49 49.07 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-O 120.55 0.214 . . . . 74.43 111.028 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.09 125.35 17.87 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.478 2.119 . . . . 61.13 112.182 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -24.23 62.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.444 . . . . 63.52 111.161 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -55.07 -43.64 74.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.366 -0.379 . . . . 73.53 111.474 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.431 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 1.5 m-20 -69.32 -54.8 12.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.27 -0.423 . . . . 74.51 111.202 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 41.1 mt -46.36 -33.25 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.929 -0.578 . . . . 62.25 111.422 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.549 HG12 HD22 ' A' ' 59' ' ' LEU . 8.2 mt -77.78 -38.03 24.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.315 -0.402 . . . . 70.33 111.033 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -67.11 -23.15 65.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.11 -0.495 . . . . 74.34 111.102 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -77.37 -49.8 14.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.036 0.446 . . . . 74.45 110.92 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 1.054 HD23 HD12 ' A' ' 66' ' ' LEU . 6.5 mt -61.77 -21.42 64.54 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.747 -0.661 . . . . 73.41 111.185 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.503 ' HA ' HD11 ' A' ' 38' ' ' LEU . 72.2 mt-30 -81.5 -58.72 2.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.99 0.424 . . . . 72.3 110.945 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -63.72 -37.45 87.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.844 -0.616 . . . . 75.34 111.746 -179.603 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.425 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 14.4 m170 -94.57 -7.9 39.75 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.764 0.283 . . . . 72.3 111.764 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.46 162.28 12.97 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.581 -0.819 . . . . 53.31 112.419 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.6 p -91.79 148.46 22.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.532 0.206 . . . . 53.3 110.524 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.732 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.7 OUTLIER -48.98 -57.08 7.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.803 0.335 . . . . 74.05 111.136 -179.729 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.8 t -48.1 -50.33 28.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.018 0.437 . . . . 61.31 110.772 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.537 ' CD1' ' HB2' ' A' ' 71' ' ' ARG . 15.9 t80 -54.09 -47.66 71.51 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.804 -0.635 . . . . 72.04 110.468 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.7 HD21 ' O ' ' A' ' 29' ' ' LEU . 13.5 mt -64.88 -41.7 95.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.944 -0.571 . . . . 71.43 110.754 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.811 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.85 -42.18 25.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.09 0.471 . . . . 73.05 110.889 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -60.53 -28.09 68.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.686 -0.688 . . . . 64.14 110.883 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 -112.56 10.02 19.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.221 -0.445 . . . . 73.13 111.131 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.91 36.2 17.72 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.801 0.334 . . . . 61.41 110.987 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.793 HD13 HD13 ' A' ' 29' ' ' LEU . 15.6 mt -95.86 -19.79 19.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 74.44 111.756 -179.527 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.811 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -77.13 159.66 29.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.077 0.465 . . . . 65.41 111.071 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.05 -122.22 5.56 Favored Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 115.706 -0.679 . . . . 74.0 112.367 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.782 ' O ' HG23 ' A' ' 50' ' ' VAL . 14.5 m120 -116.39 119.19 34.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.784 0.326 . . . . 73.43 110.925 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.535 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -46.07 -52.84 2.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.205 -0.452 . . . . 60.22 111.33 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -48.06 -36.96 13.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.914 -0.585 . . . . 70.11 110.742 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -85.61 -26.1 26.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.874 -0.603 . . . . 74.04 110.884 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.782 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.6 t -79.99 -25.97 11.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.289 -0.414 . . . . 72.41 111.331 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.33 -23.75 67.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.386 -0.37 . . . . 73.34 111.102 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -95.28 -28.62 14.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.246 -0.434 . . . . 71.43 110.883 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.5 m -101.99 33.7 2.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 61.42 110.92 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -162.45 126.45 3.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 64.24 110.944 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.72 168.12 14.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.474 . . . . 72.02 110.704 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.543 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -52.77 -58.11 7.93 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.896 0.379 . . . . 74.31 110.505 179.866 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.66 -28.56 65.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.144 -0.48 . . . . 74.15 110.187 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.48 96.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.897 -0.592 . . . . 73.3 110.264 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.592 HD23 HD21 ' A' ' 43' ' ' LEU . 8.6 mt -73.41 -32.0 64.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.564 -0.744 . . . . 72.1 110.977 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.709 HG22 ' HB3' ' A' ' 15' ' ' LEU . 33.9 t -78.4 -42.86 26.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.323 -0.399 . . . . 61.21 111.022 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.7 m -60.56 -33.99 73.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.023 -0.535 . . . . 50.24 110.521 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.462 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -82.04 -22.7 36.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.046 -0.524 . . . . 74.14 110.954 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.821 ' HA ' HD21 ' A' ' 29' ' ' LEU . 38.9 t80 -83.83 -22.81 31.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.142 -0.481 . . . . 74.54 110.989 179.674 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -84.15 -54.28 4.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 73.43 111.219 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.462 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 2.0 p-80 -62.94 -26.22 68.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.987 -0.551 . . . . 74.11 111.18 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 1.054 HD12 HD23 ' A' ' 29' ' ' LEU . 3.0 tt -48.94 -42.83 38.65 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.951 0.405 . . . . 43.31 110.91 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -79.02 -39.03 35.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.859 -0.609 . . . . 75.4 110.499 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.02 -45.13 96.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.951 -0.568 . . . . 75.51 110.685 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.5 p -89.89 -4.58 57.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.903 -0.589 . . . . 74.42 111.373 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.47 36.46 16.85 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.797 0.332 . . . . 72.24 111.24 179.651 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.537 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 7.3 mmt180 -88.58 46.05 1.35 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.246 -0.434 . . . . 72.22 111.517 -179.495 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.468 ' CE1' HD22 ' A' ' 66' ' ' LEU . 93.3 m-85 -68.17 173.22 4.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.8 0.333 . . . . 75.43 110.791 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 69.8 tttt . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.28 -0.418 . . . . 64.33 110.899 179.922 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.438 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 4.1 mttt . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.75 0.309 . . . . 74.3 110.945 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.453 ' CE2' ' HB2' ' A' ' 178' ' ' ALA . 39.4 p90 -153.79 160.68 42.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.279 -0.419 . . . . 73.01 110.91 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 79.9 m -128.93 103.5 7.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.132 -0.485 . . . . 74.14 110.897 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.404 ' HG2' ' N ' ' A' ' 114' ' ' SER . 5.3 tttt -103.14 144.27 31.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.317 -0.401 . . . . 70.32 111.045 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.498 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -139.44 120.36 14.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.161 -0.472 . . . . 73.25 110.905 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 30.6 t -75.36 106.36 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 74.25 111.288 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.498 HD22 ' O ' ' A' ' 114' ' ' SER . 3.9 mm? -80.75 -44.77 18.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 73.4 110.844 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -123.34 107.84 12.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.441 . . . . 75.11 111.049 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.5 mttm -62.44 139.58 58.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 71.22 110.803 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -106.66 -106.27 3.1 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.759 -0.734 . . . . 53.23 112.452 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -90.48 -43.8 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.965 0.412 . . . . 73.04 110.745 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.458 ' O ' HG23 ' A' ' 122' ' ' THR . 0.3 OUTLIER 72.26 38.92 0.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.918 -0.583 . . . . 73.4 110.763 -179.796 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.458 HG23 ' O ' ' A' ' 121' ' ' LYS . 0.8 OUTLIER -160.59 -44.76 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.007 -0.542 . . . . 64.22 110.785 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -85.17 106.32 16.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 75.23 110.873 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.4 ' CD1' ' O ' ' A' ' 122' ' ' THR . 18.2 m-85 -119.22 147.78 43.7 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.186 -0.461 . . . . 72.24 110.885 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.567 ' CB ' HG11 ' A' ' 166' ' ' VAL . 52.0 Cg_exo -54.33 127.99 28.19 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.579 2.186 . . . . 43.53 112.303 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.0 mmtm -103.21 147.35 27.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 75.51 110.882 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 11.5 mtpt -55.64 111.25 0.86 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 73.21 111.02 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 107.42 -16.37 37.98 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.759 -0.734 . . . . 74.11 112.693 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.76 136.78 32.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.803 0.335 . . . . 74.12 110.875 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.705 HG12 ' HG3' ' A' ' 165' ' ' LYS . 23.9 m -70.82 171.88 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.253 -0.43 . . . . 73.33 111.302 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.874 HG22 ' O ' ' A' ' 164' ' ' PHE . 19.9 m -156.63 145.47 11.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.773 -0.649 . . . . 75.34 110.529 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.573 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -127.2 117.83 23.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.683 0.278 . . . . 72.2 110.755 179.865 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.552 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.4 p -155.16 169.58 23.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.976 0.417 . . . . 74.33 111.216 -179.236 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.621 ' HB3' HD13 ' A' ' 149' ' ' ILE . 12.3 m95 -106.36 165.62 11.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.858 -0.61 . . . . 71.13 110.074 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.483 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 39.9 p90 -161.76 136.21 6.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.041 0.448 . . . . 71.54 111.837 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.849 HG21 HG11 ' A' ' 5' ' ' VAL . 1.9 m -122.77 108.8 13.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.728 -0.669 . . . . 73.32 110.19 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.672 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.15 146.02 18.11 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.573 -0.823 . . . . 75.23 113.55 -179.128 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.583 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -152.28 152.53 32.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.767 0.318 . . . . 70.32 110.575 179.771 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.885 HD21 HD12 ' A' ' 208' ' ' ILE . 14.5 mt -87.52 -177.51 5.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 74.44 110.972 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -56.87 -43.44 81.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.103 -0.498 . . . . 65.42 110.939 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.1 -9.77 59.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.997 -0.547 . . . . 71.22 111.249 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 100.91 25.83 8.26 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.669 -0.777 . . . . 62.41 112.52 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.14 108.73 17.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.775 0.321 . . . . 42.4 110.864 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.483 HG22 HG23 ' A' ' 138' ' ' THR . 39.0 t -63.67 126.4 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 74.43 111.111 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.682 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 51.7 p90 -111.83 -28.63 7.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 75.32 111.106 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -158.47 115.16 2.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.892 0.377 . . . . 74.33 111.084 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.674 HG23 HG23 ' A' ' 136' ' ' THR . 85.5 m -132.9 106.75 7.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 51.22 110.83 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.483 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 36.0 t30 -86.33 6.7 28.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.446 . . . . 72.24 111.552 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.621 HD13 ' HB3' ' A' ' 134' ' ' TRP . 12.4 mm . . . . . 0 C--N 1.33 -0.24 0 CA-C-O 120.682 0.277 . . . . 72.41 110.661 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.428 ' HB1' ' CH2' ' A' ' 134' ' ' TRP . . . . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.819 0.342 . . . . 61.12 110.994 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -132.09 121.62 17.86 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 74.24 110.855 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 161' ' ' PRO . . . . . 0.416 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 51.9 Cg_exo -54.67 150.7 34.72 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.396 2.064 . . . . 63.43 112.259 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 3.3 tt -77.89 121.13 23.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.217 -0.447 . . . . 75.25 110.49 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.652 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -99.25 121.73 41.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.945 0.402 . . . . 75.13 111.402 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.874 ' O ' HG22 ' A' ' 131' ' ' VAL . 14.7 p90 -149.25 141.02 23.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.989 -0.55 . . . . 74.32 110.652 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.705 ' HG3' HG12 ' A' ' 130' ' ' VAL . 36.2 mttp -78.07 138.04 38.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.988 0.423 . . . . 64.41 111.151 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.567 HG11 ' CB ' ' A' ' 125' ' ' PRO . 35.8 m -87.76 149.12 4.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.84 -0.618 . . . . 63.35 111.157 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.25 24.61 74.81 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.783 -0.723 . . . . 60.21 112.635 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.734 HG23 ' HG2' ' A' ' 170' ' ' LYS . 5.6 m -132.94 43.26 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.867 0.365 . . . . 73.32 111.037 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.2 36.38 5.41 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 121.151 -0.547 . . . . 73.41 113.168 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 170' ' ' LYS . . . . . 0.734 ' HG2' HG23 ' A' ' 168' ' ' VAL . 2.7 mmtm -82.47 -47.06 12.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.899 0.38 . . . . 75.3 110.997 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -119.07 -179.33 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.06 -0.518 . . . . 72.53 110.962 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.572 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -58.41 160.69 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.375 -0.375 . . . . 74.03 111.265 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -68.95 -27.91 66.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.198 -0.455 . . . . 73.05 111.259 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 174' ' ' GLY . . . . . 0.411 ' HA2' ' CE3' ' A' ' 196' ' ' TRP . . . -75.21 -37.46 42.37 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.595 -0.812 . . . . 53.14 111.98 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.691 ' CD1' HD11 ' A' ' 190' ' ' LEU . 1.8 t90 -77.86 -33.15 52.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.985 0.421 . . . . 60.44 111.033 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -63.22 -38.58 91.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.962 -0.563 . . . . 61.01 110.636 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 177' ' ' GLU . . . . . 0.429 ' O ' HG23 ' A' ' 181' ' ' THR . 2.8 mm-40 -75.5 -29.37 59.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.988 -0.551 . . . . 42.21 110.824 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.662 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -79.13 -61.94 1.85 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.436 . . . . 63.31 111.32 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.789 HD21 HG21 ' A' ' 218' ' ' VAL . 6.9 mt -53.77 -33.77 56.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.028 -0.533 . . . . 75.14 111.031 -179.753 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 49.3 tp -58.84 -28.17 65.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.368 -0.378 . . . . 74.31 110.825 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 181' ' ' THR . . . . . 0.429 HG23 ' O ' ' A' ' 177' ' ' GLU . 26.4 p -91.75 -2.96 56.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 71.3 111.404 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 1.1 ttp -77.7 156.63 30.55 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.79 0.329 . . . . 74.13 110.797 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -112.79 167.96 10.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 65.44 111.134 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 184' ' ' LYS . . . . . 0.442 ' HA ' HD22 ' A' ' 220' ' ' LEU . 3.9 tttp -68.16 126.48 29.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.961 -0.563 . . . . 72.41 111.034 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.67 33.14 71.16 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.759 -0.734 . . . . 63.02 112.683 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -118.34 148.76 42.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.793 0.33 . . . . 64.02 110.849 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -117.09 139.75 50.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.297 -0.411 . . . . 74.01 110.213 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -145.65 173.86 11.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.151 0.5 . . . . 74.42 111.866 -179.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.75 114.93 10.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.585 -0.734 . . . . 63.25 109.71 179.183 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.691 HD11 ' CD1' ' A' ' 175' ' ' TRP . 0.9 OUTLIER -126.11 141.87 51.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.501 . . . . 55.53 112.131 -178.948 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.565 ' HG3' HG23 ' A' ' 215' ' ' THR . 0.2 OUTLIER -116.76 112.89 21.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.556 -0.747 . . . . 71.1 110.236 179.345 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.466 HD11 ' CZ ' ' A' ' 216' ' ' PHE . 3.7 mp -101.09 143.48 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.971 0.415 . . . . 75.42 111.637 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.42 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.1 mt-10 -79.99 167.71 31.54 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 73.41 110.59 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 194' ' ' PRO . . . . . 0.42 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 18.8 Cg_endo -60.36 -44.03 30.55 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.45 2.1 . . . . 62.25 112.257 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.03 -25.27 11.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 73.23 111.296 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.438 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 7.4 m0 -118.02 36.95 4.13 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.472 -0.331 . . . . 53.22 111.097 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -155.25 -83.59 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 61.04 111.357 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 198' ' ' TYR . . . . . 0.491 ' HD2' HG21 ' A' ' 208' ' ' ILE . 35.6 m-85 -105.59 -27.91 11.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.898 0.38 . . . . 75.15 110.84 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 105.38 176.8 24.22 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.832 -0.699 . . . . 74.2 112.789 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -60.23 -34.65 73.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.79 0.328 . . . . 75.53 110.858 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -49.49 77.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 73.24 110.707 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.34 -158.65 14.21 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.839 -0.696 . . . . 52.44 112.605 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.451 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.0 OUTLIER -149.77 83.64 6.23 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 120.82 0.343 . . . . 63.14 110.518 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.39 -43.6 43.35 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.725 2.284 . . . . 73.51 112.727 -179.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.64 -42.13 70.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.889 0.376 . . . . 71.44 111.036 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.682 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -96.95 26.73 4.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.043 -0.526 . . . . 63.42 111.299 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.19 31.13 4.8 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.405 -0.361 . . . . 72.24 111.091 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.885 HD12 HD21 ' A' ' 139' ' ' LEU . 18.5 mm -95.72 111.72 56.71 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 74.22 111.19 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.29 161.3 43.19 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.407 2.071 . . . . 62.22 112.214 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_exo -51.62 118.62 4.6 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.489 2.126 . . . . 64.31 112.292 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 65.07 72.5 0.43 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.226 -0.443 . . . . 62.1 110.849 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -122.33 151.64 40.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 72.34 111.256 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 213' ' ' LYS . . . . . 0.523 ' O ' HD23 ' A' ' 214' ' ' LEU . 5.6 tptt -88.7 148.12 24.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.074 -0.512 . . . . 74.2 110.45 179.68 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.523 HD23 ' O ' ' A' ' 213' ' ' LYS . 8.2 mt -129.86 109.41 10.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.839 0.352 . . . . 73.34 111.363 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.565 HG23 ' HG3' ' A' ' 191' ' ' GLU . 58.5 m -106.97 138.92 42.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.062 -0.517 . . . . 71.31 110.786 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.672 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 9.0 p90 -161.8 -175.4 4.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.265 -0.425 . . . . 64.1 111.053 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 217' ' ' GLU . . . . . 0.457 ' HG2' ' HA ' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -144.65 147.96 33.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 73.32 110.807 -179.946 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.789 HG21 HD21 ' A' ' 179' ' ' LEU . 1.5 t -125.89 153.36 33.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.98 -0.555 . . . . 71.13 112.025 -178.192 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -133.93 106.11 7.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.846 -0.615 . . . . 74.54 110.031 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.621 HD21 ' CG1' ' A' ' 223' ' ' ILE . 1.3 tt -69.93 130.97 43.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.406 -0.361 . . . . 55.31 110.996 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 28.1 t -109.3 -29.72 2.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.17 -0.468 . . . . 74.55 111.466 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 222' ' ' ASP . . . . . 0.408 ' N ' HD23 ' A' ' 220' ' ' LEU . 4.0 t0 -171.11 161.67 6.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.869 0.366 . . . . 74.2 111.267 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.678 HG23 HG12 ' A' ' 131' ' ' VAL . 39.3 mt -141.96 111.45 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.087 -0.506 . . . . 74.04 110.99 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 74.4 110.899 179.979 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 1.033 HG11 HG21 ' A' ' 136' ' ' THR . 60.1 t . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.653 0.263 . . . . 73.14 111.063 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.446 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 72.0 Cg_endo -77.18 137.75 17.38 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.708 2.272 . . . . 75.21 112.456 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -82.35 148.1 28.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 72.44 110.76 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.89 97.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 71.34 111.207 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.95 -16.36 63.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.482 . . . . 51.41 111.397 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.451 ' CZ3' ' HA ' ' A' ' 25' ' ' ILE . 4.1 m-90 -129.44 161.87 29.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.948 0.404 . . . . 70.41 110.812 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.5 m -100.48 150.02 23.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.873 -0.603 . . . . 71.3 110.148 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.485 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 46.3 t -56.85 -36.84 51.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.958 0.409 . . . . 62.24 110.47 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.411 ' O ' ' HB2' ' A' ' 17' ' ' SER . 3.7 pt-20 -69.1 -22.71 63.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.814 -0.63 . . . . 55.25 110.852 179.366 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.434 ' O ' ' HB2' ' A' ' 17' ' ' SER . 26.0 mt-30 -82.03 -54.49 5.26 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.358 -0.383 . . . . 75.53 111.174 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.8 ' HB3' HG22 ' A' ' 60' ' ' VAL . 7.1 mt -50.11 -66.38 0.4 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 60.3 111.782 -179.208 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.485 ' HG2' ' O ' ' A' ' 12' ' ' VAL . 2.5 ptm180 -59.4 -25.23 64.12 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 120.957 -0.297 . . . . 74.44 111.242 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.434 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -52.03 179.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.919 0.39 . . . . 55.33 111.144 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -110.36 16.43 21.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.055 -0.521 . . . . 73.32 111.199 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.85 -23.75 8.48 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.497 -0.32 . . . . 74.42 111.184 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.918 HD12 HD11 ' A' ' 25' ' ' ILE . 1.2 tm? -80.67 117.2 66.78 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.454 -0.339 . . . . 74.12 110.856 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.546 ' HD2' HD22 ' A' ' 20' ' ' LEU . 37.3 Cg_endo -65.85 123.65 11.62 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.466 2.11 . . . . 72.22 112.425 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -27.82 69.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.112 -0.495 . . . . 62.23 111.278 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.462 ' HA ' HD12 ' A' ' 26' ' ' ILE . 3.0 ttpt -53.47 -39.51 64.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.909 0.385 . . . . 75.42 111.122 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.53 -53.65 9.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.059 -0.519 . . . . 41.25 110.658 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.918 HD11 HD12 ' A' ' 20' ' ' LEU . 36.2 mt -45.63 -33.63 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.799 -0.637 . . . . 71.01 111.342 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.747 ' HB ' HG23 ' A' ' 47' ' ' ILE . 6.0 mt -76.02 -40.21 37.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 61.02 111.037 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -69.43 -23.53 63.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.03 -0.532 . . . . 73.15 111.263 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.451 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 22.9 t80 -74.84 -46.4 36.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.964 0.411 . . . . 75.52 111.124 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.792 HD21 ' HA ' ' A' ' 63' ' ' TYR . 4.5 mt -69.03 -24.67 64.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.963 -0.562 . . . . 74.51 111.185 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.594 ' HA ' HD11 ' A' ' 38' ' ' LEU . 74.6 mt-30 -80.2 -28.37 38.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.387 -0.37 . . . . 73.14 110.98 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -94.29 -41.06 9.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.297 -0.41 . . . . 64.31 111.113 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.451 ' ND1' ' CZ ' ' A' ' 28' ' ' PHE . 11.7 m170 -90.3 -7.32 53.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.301 -0.408 . . . . 75.35 111.477 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.8 164.83 12.99 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.698 -0.763 . . . . 53.22 112.401 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.3 p -92.43 148.39 22.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.671 0.272 . . . . 74.25 110.614 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.604 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.5 OUTLIER -48.66 -57.08 6.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.785 0.326 . . . . 72.24 111.012 -179.804 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.65 -50.72 31.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 74.24 110.706 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.511 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 19.8 t80 -53.78 -47.97 70.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.751 -0.659 . . . . 72.2 110.287 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.712 HD21 ' O ' ' A' ' 29' ' ' LEU . 14.9 mt -63.83 -41.57 97.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.901 -0.591 . . . . 73.22 110.763 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.775 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.55 -40.21 18.35 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.2 -0.455 . . . . 71.45 111.095 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -48.59 -48.78 38.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.864 -0.607 . . . . 64.43 110.972 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.6 m80 -103.45 13.64 33.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 75.12 111.223 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 58.17 43.38 20.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.837 0.351 . . . . 64.15 110.894 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.735 HD13 HD13 ' A' ' 29' ' ' LEU . 20.4 mt -95.22 -20.91 18.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 70.02 111.615 -179.593 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.775 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -75.97 158.32 32.1 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.007 0.432 . . . . 44.41 111.127 -179.924 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.76 -124.23 6.1 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.978 -0.629 . . . . 73.44 112.42 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.894 ' O ' HG23 ' A' ' 50' ' ' VAL . 3.7 m120 -116.3 121.18 41.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.783 0.325 . . . . 74.01 110.945 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.747 HG23 ' HB ' ' A' ' 26' ' ' ILE . 2.4 mp -46.76 -50.53 5.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.223 -0.444 . . . . 55.54 111.335 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mttm -50.41 -38.64 43.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.923 -0.581 . . . . 73.54 110.753 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -85.57 -26.3 26.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.881 -0.599 . . . . 64.41 110.9 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.894 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.0 t -79.2 -26.22 12.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.28 -0.418 . . . . 74.22 111.313 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.01 -23.34 67.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.399 -0.364 . . . . 74.23 111.123 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -95.22 -28.06 15.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 61.45 110.9 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.02 33.64 2.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 72.4 110.918 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -159.54 124.51 4.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 13.42 110.962 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -83.85 171.09 13.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 71.12 110.755 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.777 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -55.27 -57.92 9.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.391 . . . . 75.21 110.599 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.32 -26.19 67.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.985 -0.552 . . . . 63.35 110.435 179.338 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -45.18 93.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.995 -0.548 . . . . 65.3 110.492 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.641 HD21 HG12 ' A' ' 26' ' ' ILE . 24.6 mt -74.68 -29.14 61.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.695 -0.684 . . . . 73.15 111.101 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.8 HG22 ' HB3' ' A' ' 15' ' ' LEU . 5.9 t -79.71 -43.52 23.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.972 0.415 . . . . 64.24 110.885 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.7 m -61.0 -34.99 75.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.911 -0.586 . . . . 70.54 110.761 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.451 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -81.33 -23.39 37.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 51.1 111.073 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.792 ' HA ' HD21 ' A' ' 29' ' ' LEU . 27.0 t80 -83.74 -22.79 31.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 73.41 110.945 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.1 m-20 -83.42 -54.61 4.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 73.24 111.39 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.511 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.3 p-80 -62.59 -25.79 68.26 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.114 -0.494 . . . . 62.43 111.327 -179.411 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.715 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.0 tt -53.25 -40.07 64.32 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.877 0.37 . . . . 71.41 110.935 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -78.71 -38.93 37.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.029 -0.532 . . . . 73.11 110.621 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.86 -41.26 91.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.023 -0.535 . . . . 73.4 110.772 179.834 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.9 p -90.85 -4.14 56.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.938 -0.574 . . . . 64.51 111.437 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.98 37.93 11.38 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.735 0.302 . . . . 73.32 111.351 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.425 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 27.0 mtt-85 -94.13 44.1 1.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.383 -0.371 . . . . 63.34 111.092 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.534 ' HA ' HD21 ' A' ' 66' ' ' LEU . 86.0 m-85 -64.32 177.75 0.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 71.23 110.832 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.3 tttt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 63.43 110.913 179.913 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.439 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 1.8 mptt . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.857 0.36 . . . . 74.14 110.957 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.427 ' CE1' ' HB2' ' A' ' 177' ' ' GLU . 34.3 p90 -151.99 152.36 32.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.207 -0.451 . . . . 73.23 110.886 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 62.9 m -124.08 103.62 8.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 62.03 110.947 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt -97.09 151.34 19.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.445 . . . . 75.24 110.834 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.421 ' O ' HD22 ' A' ' 116' ' ' LEU . 1.4 t -148.69 118.62 7.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.248 -0.433 . . . . 72.34 111.018 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 40.7 t -78.62 106.33 9.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.461 . . . . 61.41 111.242 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.527 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -81.8 -41.26 21.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.419 . . . . 73.02 110.7 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 8.2 ttpp -125.51 109.15 12.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 61.45 111.008 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.4 mttp -61.14 139.44 58.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 74.44 110.937 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -97.33 -108.3 2.59 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.802 -0.713 . . . . 65.51 112.478 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -96.42 -37.32 10.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.967 0.413 . . . . 73.51 110.7 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.4 36.87 0.61 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.885 -0.598 . . . . 74.42 110.911 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 58.8 m -163.09 -43.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 71.34 111.086 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -81.81 86.05 6.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.286 -0.416 . . . . 74.32 111.158 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -102.74 143.36 26.45 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 75.42 110.743 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.633 ' HA ' HG21 ' A' ' 223' ' ' ILE . 52.7 Cg_exo -55.51 130.96 43.36 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.559 2.173 . . . . 74.51 112.575 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.12 147.31 24.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 72.11 110.735 179.786 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -53.3 116.94 2.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.329 -0.396 . . . . 75.52 111.139 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 93.8 -4.27 71.86 Favored Glycine 0 CA--C 1.519 0.326 0 C-N-CA 120.732 -0.747 . . . . 73.52 112.876 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.21 139.5 30.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.869 0.366 . . . . 70.0 110.972 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.613 HG12 ' O ' ' A' ' 224' ' ' ASP . 7.8 p -69.39 162.23 3.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 72.43 111.055 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.92 HG12 HG23 ' A' ' 223' ' ' ILE . 13.4 m -154.86 145.95 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 65.13 111.031 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.463 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -128.08 117.97 22.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.722 0.296 . . . . 74.55 110.951 179.909 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.447 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 22.9 p -151.36 166.76 30.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.92 0.39 . . . . 51.44 111.216 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.652 ' O ' HG13 ' A' ' 218' ' ' VAL . 15.8 m95 -100.93 160.9 13.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.017 -0.538 . . . . 71.43 109.961 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.486 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 17.4 p90 -161.28 138.1 8.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.917 0.389 . . . . 74.31 111.632 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' THR . . . . . 1.033 HG21 HG11 ' A' ' 5' ' ' VAL . 3.5 m -126.33 109.06 11.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.999 -0.546 . . . . 74.43 111.043 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.724 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -86.94 138.31 15.41 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.834 -0.698 . . . . 73.1 113.111 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.863 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.98 132.56 14.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.705 0.288 . . . . 50.44 110.522 179.547 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.494 HD21 HG23 ' A' ' 208' ' ' ILE . 40.8 mt -70.44 -178.37 1.73 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.381 -0.372 . . . . 74.03 110.991 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -57.15 -42.71 81.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.086 -0.507 . . . . 61.21 110.774 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -76.03 -3.08 33.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.935 -0.575 . . . . 71.12 111.493 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' GLY . . . . . 0.434 ' O ' HG22 ' A' ' 138' ' ' THR . . . 90.67 8.39 65.63 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.629 -0.796 . . . . 74.2 112.91 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.01 110.01 11.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.785 0.326 . . . . 72.14 110.684 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 137' ' ' GLY . 7.3 p -63.67 133.04 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.289 -0.414 . . . . 54.23 111.158 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.429 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 46.1 p90 -111.22 -29.3 7.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 72.03 110.832 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -168.21 121.8 0.9 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 64.5 110.866 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.674 ' OG1' HG23 ' A' ' 136' ' ' THR . 12.5 t -142.82 128.25 18.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.37 -0.377 . . . . 74.15 111.077 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.486 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 25.2 t-20 -89.14 53.29 2.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.096 -0.502 . . . . 65.2 110.631 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . 3.2 mt . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 52.1 111.394 179.964 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.802 0.334 . . . . 22.22 111.116 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 160' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 161' ' ' PRO . 23.4 mttm -138.52 134.69 17.54 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 70.11 110.776 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 161' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 160' ' ' LYS . 31.1 Cg_exo -58.76 152.18 58.7 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.378 2.052 . . . . 53.32 112.351 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.62 125.56 29.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 70.51 110.306 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.628 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.66 122.91 43.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.991 0.424 . . . . 73.44 111.585 -179.66 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.867 ' O ' HG22 ' A' ' 131' ' ' VAL . 6.6 p90 -151.31 143.62 24.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.859 -0.609 . . . . 74.32 110.516 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.583 ' O ' HG22 ' A' ' 168' ' ' VAL . 34.6 mttt -81.7 142.0 33.08 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 75.33 111.043 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.5 m -87.69 149.03 4.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.897 -0.592 . . . . 73.2 111.285 -179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 67.91 25.11 74.36 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.851 -0.69 . . . . 70.52 112.592 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.608 HG23 ' HG2' ' A' ' 170' ' ' LYS . 27.3 m -131.3 41.11 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.788 0.327 . . . . 73.24 111.174 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.22 35.25 2.49 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 121.194 -0.527 . . . . 72.12 113.151 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 170' ' ' LYS . . . . . 0.608 ' HG2' HG23 ' A' ' 168' ' ' VAL . 0.0 OUTLIER -83.69 -43.55 15.43 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.794 0.331 . . . . 64.33 111.178 -179.777 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 171' ' ' VAL . . . . . 0.434 HG22 ' CE2' ' A' ' 164' ' ' PHE . 2.8 m -119.14 179.38 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.166 -0.47 . . . . 61.44 111.147 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.56 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.4 163.61 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 73.41 111.217 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 173' ' ' ARG . . . . . 0.442 ' HD3' ' CZ2' ' A' ' 196' ' ' TRP . 14.7 ttm105 -70.13 -29.75 66.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.234 -0.439 . . . . 74.3 111.227 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.36 -36.49 49.86 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.603 -0.808 . . . . 74.11 112.02 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.79 ' HE1' HG21 ' A' ' 218' ' ' VAL . 1.7 t90 -79.76 -34.34 39.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.052 0.453 . . . . 73.52 110.874 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 176' ' ' ASP . . . . . 0.792 ' O ' HD13 ' A' ' 180' ' ' LEU . 14.8 t70 -62.82 -33.28 74.9 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.751 -0.659 . . . . 51.0 110.403 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 177' ' ' GLU . . . . . 0.427 ' HB2' ' CE1' ' A' ' 111' ' ' TYR . 3.9 mm-40 -80.77 -29.09 36.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.527 . . . . 71.13 110.68 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.504 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -78.8 -61.93 1.86 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.445 . . . . 73.23 111.175 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.712 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 10.1 mt -53.65 -28.14 31.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.967 -0.56 . . . . 55.25 110.794 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.792 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.1 tp -53.38 -29.75 36.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.115 -0.493 . . . . 53.54 111.272 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 60.2 p -108.87 7.7 26.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.382 -0.372 . . . . 64.22 111.7 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.422 ' O ' HD13 ' A' ' 220' ' ' LEU . 26.7 mmm -69.78 106.03 2.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.889 0.376 . . . . 70.33 110.884 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.09 150.25 48.46 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.969 -0.56 . . . . 74.14 111.036 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 184' ' ' LYS . . . . . 0.71 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -56.12 119.94 6.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.56 . . . . 62.02 110.9 -179.869 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 74.97 20.33 79.5 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.705 -0.76 . . . . 32.23 112.431 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -96.95 143.41 27.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.846 0.355 . . . . 63.23 111.081 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt -110.45 132.9 53.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.061 -0.518 . . . . 74.33 109.787 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -143.08 171.52 13.96 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.235 0.54 . . . . 74.34 112.09 -179.34 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 189' ' ' ARG . . . . . 0.449 ' HA ' ' HA ' ' A' ' 217' ' ' GLU . 0.0 OUTLIER -137.09 117.6 13.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.299 -0.864 . . . . 74.22 109.504 179.587 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.923 HD21 ' CE2' ' A' ' 216' ' ' PHE . 2.2 pt? -127.6 141.23 51.68 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.212 -0.595 . . . . 34.41 112.545 -178.791 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.724 ' HG3' HG23 ' A' ' 215' ' ' THR . 1.4 mp0 -113.59 116.12 29.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.271 -0.877 . . . . 74.24 109.864 179.034 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.425 HG12 ' CE1' ' A' ' 216' ' ' PHE . 4.5 mm -91.42 144.81 8.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.857 0.36 . . . . 60.41 111.372 -179.364 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -84.47 154.49 62.53 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.069 -0.514 . . . . 74.41 110.481 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 194' ' ' PRO . . . . . 0.415 ' O ' ' N ' ' A' ' 199' ' ' GLY . 63.7 Cg_exo -51.07 -44.2 43.76 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.458 2.105 . . . . 64.42 112.376 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -62.36 -19.74 63.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 74.02 111.629 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.442 ' CZ2' ' HD3' ' A' ' 173' ' ' ARG . 6.3 m0 -118.55 37.1 4.16 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.64 0.257 . . . . 71.5 111.528 -179.587 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -156.19 -84.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.634 -0.257 . . . . 74.34 111.581 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 198' ' ' TYR . . . . . 0.881 ' CE2' HD13 ' A' ' 208' ' ' ILE . 19.6 m-85 -104.96 -26.19 12.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.853 0.359 . . . . 74.41 111.061 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 199' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 194' ' ' PRO . . . 105.85 163.33 23.17 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.833 -0.699 . . . . 54.41 112.474 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 28.7 mtmt -55.49 -30.91 61.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.825 0.345 . . . . 75.53 110.824 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 18.8 mtpt -61.21 -48.53 81.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 73.14 110.795 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 106.72 166.32 22.53 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.836 -0.697 . . . . 34.04 112.487 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.841 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.7 OUTLIER -110.68 90.02 10.0 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.701 0.286 . . . . 62.44 110.832 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.17 -21.59 55.21 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.459 2.106 . . . . 73.54 112.409 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.46 -41.6 85.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.318 -0.401 . . . . 64.42 110.923 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -108.11 27.33 9.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.061 -0.518 . . . . 62.32 111.199 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 56.16 54.44 7.82 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.429 . . . . 73.44 111.108 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.881 HD13 ' CE2' ' A' ' 198' ' ' TYR . 27.1 mt -117.35 111.63 39.98 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 74.4 111.06 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 209' ' ' PRO . . . . . 0.41 ' HA ' ' HD3' ' A' ' 210' ' ' PRO . 38.4 Cg_exo -60.68 157.76 35.84 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.525 2.15 . . . . 55.41 112.373 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 210' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 209' ' ' PRO . 31.2 Cg_exo -61.17 130.52 32.67 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.651 2.234 . . . . 75.34 112.142 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 64.09 69.6 0.53 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.337 -0.392 . . . . 54.14 110.873 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -122.87 149.23 44.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.216 -0.447 . . . . 64.3 111.261 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 213' ' ' LYS . . . . . 0.9 ' O ' HD23 ' A' ' 214' ' ' LEU . 2.3 tttt -83.94 149.77 26.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.03 -0.532 . . . . 74.1 110.554 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.9 HD23 ' O ' ' A' ' 213' ' ' LYS . 7.2 mt -136.19 109.35 7.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.89 0.376 . . . . 54.11 111.576 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.724 HG23 ' HG3' ' A' ' 191' ' ' GLU . 45.7 m -109.95 138.23 46.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 71.14 110.184 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.923 ' CE2' HD21 ' A' ' 190' ' ' LEU . 12.4 p90 -157.79 120.36 3.83 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 112.386 0.513 . . . . 75.52 112.386 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 217' ' ' GLU . . . . . 0.449 ' HA ' ' HA ' ' A' ' 189' ' ' ARG . 2.6 mt-10 -74.17 136.46 42.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.628 -0.714 . . . . 64.14 110.654 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.79 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.3 t -122.41 150.89 26.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.077 -0.511 . . . . 75.35 111.525 -178.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -136.77 110.18 7.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.039 -0.528 . . . . 54.43 110.491 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.828 HD21 HG13 ' A' ' 223' ' ' ILE . 3.5 tt -70.53 132.16 45.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.404 -0.362 . . . . 74.3 111.145 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.408 HG21 ' HE1' ' A' ' 134' ' ' TRP . 30.8 t -109.68 -30.69 2.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.103 -0.499 . . . . 53.44 111.429 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 222' ' ' ASP . . . . . 0.423 ' N ' HD23 ' A' ' 220' ' ' LEU . 6.5 t70 -168.94 159.3 9.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.875 0.369 . . . . 75.24 111.107 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.92 HG23 HG12 ' A' ' 131' ' ' VAL . 29.2 mt -142.25 112.01 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 64.2 111.157 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 224' ' ' ASP . . . . . 0.613 ' O ' HG12 ' A' ' 130' ' ' VAL . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 73.33 110.826 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.954 HG11 HG21 ' A' ' 136' ' ' THR . 40.7 t . . . . . 0 CA--C 1.529 0.151 0 CA-C-O 120.59 0.233 . . . . 65.2 110.84 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.457 ' HB3' ' CE1' ' A' ' 32' ' ' HIS . 93.0 Cg_endo -79.21 135.06 11.88 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.533 2.155 . . . . 74.2 112.46 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -80.31 150.63 29.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.181 -0.463 . . . . 63.23 110.803 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.13 96.03 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.184 -0.462 . . . . 75.42 111.209 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.63 -16.46 64.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 74.13 111.396 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 6.0 m-90 -136.0 173.67 11.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.848 0.356 . . . . 73.34 110.789 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.449 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -116.79 152.11 35.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.113 -0.494 . . . . 74.13 110.597 179.776 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.417 ' CG1' ' HD2' ' A' ' 16' ' ' ARG . 38.2 t -55.88 -32.74 33.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.264 -0.425 . . . . 64.24 110.928 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -72.33 -26.65 62.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.992 -0.549 . . . . 73.25 111.202 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.449 ' HB2' HG23 ' A' ' 11' ' ' THR . 17.3 mt-30 -82.19 -56.44 3.92 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.842 0.353 . . . . 65.32 111.056 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.689 HD13 HG13 ' A' ' 60' ' ' VAL . 1.3 mt -49.58 -65.43 0.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.301 -0.409 . . . . 62.4 111.328 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.558 ' HG3' HG11 ' A' ' 60' ' ' VAL . 4.7 mtp-105 -55.75 -25.09 39.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 73.32 111.356 -179.73 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.412 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.1 OUTLIER -56.4 -179.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.01 0.434 . . . . 63.15 111.175 -179.799 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -109.41 16.76 22.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.937 -0.574 . . . . 60.41 111.108 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -114.51 -27.86 7.39 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.485 -0.325 . . . . 75.44 111.097 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.899 HD12 HD11 ' A' ' 25' ' ' ILE . 2.5 tm? -81.94 112.61 36.6 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.392 . . . . 53.11 110.954 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -60.66 123.34 12.82 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.52 2.146 . . . . 65.3 112.364 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -24.15 67.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 75.54 111.192 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -53.61 -40.53 65.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.886 0.374 . . . . 75.41 111.232 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.98 -52.5 14.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.092 -0.504 . . . . 71.42 110.728 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.899 HD11 HD12 ' A' ' 20' ' ' LEU . 42.8 mt -44.87 -30.74 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.707 -0.679 . . . . 73.2 111.295 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.795 ' HB ' HG23 ' A' ' 47' ' ' ILE . 7.3 mt -81.76 -55.2 8.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.053 0.454 . . . . 65.44 110.765 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.454 ' HG2' HD11 ' A' ' 47' ' ' ILE . 24.3 mttt -52.44 -27.12 14.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.687 -0.688 . . . . 74.42 110.935 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.454 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 42.7 t80 -77.24 -48.63 17.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.075 -0.511 . . . . 72.3 110.969 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.792 HD21 ' HA ' ' A' ' 63' ' ' TYR . 6.3 mt -67.13 -26.44 66.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.859 -0.609 . . . . 74.23 111.336 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -75.3 -35.66 61.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.942 0.401 . . . . 73.44 110.717 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.424 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 14.9 pt-20 -87.63 -31.19 19.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 70.04 111.075 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.457 ' CE1' ' HB3' ' A' ' 6' ' ' PRO . 19.7 m170 -98.95 -9.02 24.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.289 -0.414 . . . . 75.31 111.571 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -109.86 155.65 15.98 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.719 -0.753 . . . . 63.24 112.318 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.3 p -97.3 153.11 18.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.562 0.22 . . . . 62.31 110.539 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.817 ' HA ' HD12 ' A' ' 38' ' ' LEU . 0.8 OUTLIER -42.89 -48.57 5.84 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.847 0.356 . . . . 72.31 111.371 -179.702 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.6 m -52.85 -50.89 62.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.123 -0.489 . . . . 60.25 110.507 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.759 ' CZ ' HD12 ' A' ' 66' ' ' LEU . 1.1 t80 -60.47 -31.95 70.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.623 -0.717 . . . . 73.33 110.355 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.817 HD12 ' HA ' ' A' ' 35' ' ' ASP . 5.9 mt -75.86 -54.75 6.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.004 -0.543 . . . . 65.24 111.307 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.78 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -50.02 -35.0 23.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.351 -0.386 . . . . 63.55 111.751 -179.63 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -72.64 -31.13 64.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.242 -0.435 . . . . 65.51 111.523 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.437 ' CD2' ' CB ' ' A' ' 62' ' ' ALA . 2.7 m-70 -109.91 10.33 24.39 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.734 0.272 . . . . 62.52 111.734 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.407 ' N ' ' O ' ' A' ' 38' ' ' LEU . 7.7 mmmt 58.43 35.63 24.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.745 0.307 . . . . 62.12 111.217 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.695 ' CB ' HD23 ' A' ' 38' ' ' LEU . 49.4 mt -90.96 -16.93 27.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.427 -0.352 . . . . 75.31 111.017 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.78 HD11 ' HB2' ' A' ' 39' ' ' ALA . 56.7 mt -50.76 170.46 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.042 0.449 . . . . 61.11 111.32 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.23 -155.94 29.04 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.927 -0.654 . . . . 63.41 112.951 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.887 ' O ' HG23 ' A' ' 50' ' ' VAL . 72.9 m-80 -100.57 141.88 32.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.968 0.413 . . . . 74.14 111.051 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.795 HG23 ' HB ' ' A' ' 26' ' ' ILE . 2.9 mp -45.31 -47.24 3.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.883 -0.598 . . . . 73.11 111.526 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mttm -51.61 -41.58 61.34 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.983 -0.553 . . . . 61.21 111.065 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -85.7 -28.35 24.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.013 -0.54 . . . . 73.33 111.113 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.3 t -74.0 -27.72 22.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.278 -0.419 . . . . 75.52 111.535 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.45 -24.1 67.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.386 -0.37 . . . . 73.43 111.434 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -95.24 -27.3 15.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.341 -0.391 . . . . 71.51 111.28 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.7 m -84.19 -24.38 30.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.362 -0.381 . . . . 72.24 111.403 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -116.57 132.7 56.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.842 0.354 . . . . 50.55 111.31 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -79.71 -178.61 6.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.126 -0.488 . . . . 72.31 110.409 179.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.72 ' O ' HG23 ' A' ' 60' ' ' VAL . 22.8 mmmt -60.96 -58.46 8.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.788 0.328 . . . . 73.34 110.494 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.29 -30.18 71.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.211 -0.45 . . . . 75.14 110.512 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.35 -39.64 80.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.5 . . . . 71.45 110.443 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.595 HD21 HG12 ' A' ' 26' ' ' ILE . 30.5 mt -79.36 -27.36 41.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.588 -0.733 . . . . 53.35 111.022 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.72 HG23 ' O ' ' A' ' 56' ' ' LYS . 10.9 t -79.9 -44.26 22.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.969 0.414 . . . . 63.51 110.774 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 79.2 m -60.61 -35.8 77.02 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.896 -0.593 . . . . 63.15 110.236 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.437 ' CB ' ' CD2' ' A' ' 41' ' ' HIS . . . -78.7 -23.19 45.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.855 -0.611 . . . . 50.13 110.774 179.49 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.792 ' HA ' HD21 ' A' ' 29' ' ' LEU . 83.2 t80 -82.97 -22.74 33.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.086 -0.506 . . . . 75.41 111.016 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.434 ' ND2' HG12 ' A' ' 60' ' ' VAL . 39.0 m-80 -85.47 -53.73 5.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 75.44 111.242 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -24.35 67.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.008 -0.542 . . . . 63.45 111.408 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.759 HD12 ' CZ ' ' A' ' 37' ' ' PHE . 6.3 tt -56.06 -39.1 71.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.92 0.39 . . . . 75.41 110.904 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.402 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.4 m-85 -77.85 -40.69 39.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.975 -0.557 . . . . 64.11 110.613 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -66.37 -37.73 85.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.542 . . . . 65.24 110.711 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 75.5 p -91.13 -7.25 52.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.964 -0.562 . . . . 74.13 111.329 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.8 mtmt 51.21 35.43 13.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.739 0.304 . . . . 61.41 111.438 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 41.9 mtt-85 -91.93 44.4 1.17 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.374 -0.375 . . . . 73.42 111.146 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.403 ' CE2' ' HD2' ' A' ' 6' ' ' PRO . 88.9 m-85 -65.72 176.53 1.51 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.288 -0.414 . . . . 74.41 110.701 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.5 tttt . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 74.24 110.897 179.976 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.794 0.33 . . . . 64.11 110.955 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -154.82 167.33 30.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.285 -0.416 . . . . 73.42 111.015 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 82.0 m -136.72 103.52 5.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.016 -0.538 . . . . 75.51 110.725 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 190' ' ' LEU . 21.5 ptmt -108.14 151.45 25.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.948 0.404 . . . . 73.35 111.196 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.434 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.4 OUTLIER -142.49 123.16 14.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.952 -0.567 . . . . 74.32 110.547 179.829 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.609 ' O ' HG13 ' A' ' 115' ' ' VAL . 9.1 p -77.56 106.24 7.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.284 -0.417 . . . . 72.11 111.173 -179.834 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.5 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.5 mm? -77.73 -42.18 35.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 71.13 110.855 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.3 tttm -130.46 108.18 9.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 65.14 110.962 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 138.28 57.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 72.0 110.844 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.503 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -109.22 -156.19 17.01 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.631 -0.795 . . . . 75.22 112.645 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -36.53 -51.21 0.83 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.919 0.39 . . . . 73.4 111.651 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 66.99 34.58 5.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.836 -0.62 . . . . 75.55 110.296 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 55.1 m -151.88 -44.06 0.11 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.697 -0.683 . . . . 72.14 110.66 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -91.5 92.65 8.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 73.53 110.903 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -100.74 153.66 37.61 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 73.03 110.791 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.601 ' HB2' HG21 ' A' ' 166' ' ' VAL . 59.5 Cg_endo -71.88 125.55 11.12 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.52 2.147 . . . . 70.31 112.443 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.0 mtmm -95.54 156.9 16.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.113 -0.494 . . . . 73.24 110.956 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.8 mttp -57.88 118.71 5.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 74.33 110.865 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 99.24 -23.44 36.29 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.643 -0.789 . . . . 74.33 112.507 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.414 ' O ' HG22 ' A' ' 166' ' ' VAL . 3.5 m-20 -78.6 136.91 37.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.746 0.308 . . . . 73.11 110.738 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.599 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 17.1 m -73.12 173.46 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.107 0.479 . . . . 63.42 111.655 -179.778 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.683 HG12 HG23 ' A' ' 223' ' ' ILE . 19.4 m -156.78 145.87 11.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.507 -0.769 . . . . 73.31 110.568 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.617 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -126.16 117.72 23.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.639 0.257 . . . . 74.13 110.454 179.506 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 133' ' ' CYS . . . . . 0.436 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.9 p -150.8 169.91 20.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.104 0.478 . . . . 54.31 111.512 -179.225 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' TRP . . . . . 0.511 ' O ' HG13 ' A' ' 218' ' ' VAL . 85.6 m95 -101.88 156.35 17.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.559 -0.746 . . . . 73.14 109.531 179.246 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.569 ' H ' HD11 ' A' ' 149' ' ' ILE . 31.8 p90 -161.27 137.66 8.34 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 120.314 -0.554 . . . . 74.21 112.304 -179.361 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.954 HG21 HG11 ' A' ' 5' ' ' VAL . 12.8 m -127.88 111.56 13.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.485 -0.779 . . . . 62.04 110.195 179.312 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 137' ' ' GLY . . . . . 0.555 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.52 145.54 17.88 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.577 -0.821 . . . . 74.01 113.13 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.738 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.6 OUTLIER -150.71 153.02 34.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.8 0.334 . . . . 62.14 110.893 179.834 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.618 HD12 ' HB ' ' A' ' 143' ' ' THR . 69.5 mt -92.07 179.23 5.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.01 110.757 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -57.04 -44.4 82.9 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.961 0.41 . . . . 73.35 110.996 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.01 -8.54 56.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.968 -0.56 . . . . 70.53 111.313 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 95.94 25.81 12.47 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.644 -0.789 . . . . 54.44 112.523 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' THR . . . . . 0.618 ' HB ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -93.89 112.59 24.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.836 0.35 . . . . 72.31 110.777 179.977 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.434 HG12 HG23 ' A' ' 138' ' ' THR . 4.6 m -63.7 135.08 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 73.03 111.142 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.463 ' HB2' HD11 ' A' ' 208' ' ' ILE . 39.9 p90 -116.27 -39.39 3.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.49 . . . . 72.14 110.882 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -143.41 110.3 5.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.042 -0.526 . . . . 72.52 110.751 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.453 ' CG2' HG23 ' A' ' 136' ' ' THR . 67.3 m -142.82 107.57 4.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 73.42 111.138 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -97.74 35.42 1.69 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 73.25 110.477 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.569 HD11 ' H ' ' A' ' 135' ' ' TYR . 20.2 mm . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.08 -0.509 . . . . 72.44 111.095 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.801 0.334 . . . . 74.11 111.056 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 6.5 mttm -146.38 149.53 37.97 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 63.31 110.959 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.07 155.73 68.16 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.603 2.202 . . . . 73.04 112.223 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.66 123.64 24.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 72.01 110.692 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 163' ' ' SER . . . . . 0.655 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.5 OUTLIER -104.81 124.5 49.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.895 0.378 . . . . 64.25 111.083 179.866 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 164' ' ' PHE . . . . . 0.713 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 16.3 p90 -151.26 142.14 22.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 75.13 110.906 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 165' ' ' LYS . . . . . 0.599 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 33.0 mttt -74.24 133.75 42.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.431 . . . . 73.35 111.174 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 166' ' ' VAL . . . . . 0.601 HG21 ' HB2' ' A' ' 125' ' ' PRO . 35.0 m -87.76 149.35 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.863 -0.608 . . . . 74.54 111.085 -179.619 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 69.28 22.07 76.08 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.777 -0.725 . . . . 74.0 112.608 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 168' ' ' VAL . . . . . 0.588 HG21 ' CB ' ' A' ' 165' ' ' LYS . 11.8 m -132.38 44.16 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.904 0.383 . . . . 60.33 111.059 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.17 36.36 4.02 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.171 -0.537 . . . . 51.2 113.223 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.59 -47.1 14.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.96 0.409 . . . . 53.31 110.881 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 171' ' ' VAL . . . . . 0.42 HG22 ' CE1' ' A' ' 164' ' ' PHE . 0.0 OUTLIER -119.37 -178.66 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.98 -0.554 . . . . 73.11 110.895 179.778 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 172' ' ' ILE . . . . . 0.564 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 4.2 pt -58.16 159.58 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.333 -0.394 . . . . 72.34 111.143 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -68.56 -29.61 68.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.347 -0.388 . . . . 75.44 111.152 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -72.57 -38.39 57.55 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.542 -0.837 . . . . 73.34 111.888 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 175' ' ' TRP . . . . . 0.608 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.0 t90 -77.65 -32.54 53.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.865 0.365 . . . . 75.45 110.94 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -62.61 -34.46 77.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.08 -0.509 . . . . 53.32 110.305 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -78.41 -29.86 47.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.993 -0.549 . . . . 71.31 110.679 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 178' ' ' ALA . . . . . 0.538 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -78.78 -59.07 2.93 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.163 -0.472 . . . . 73.31 111.293 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.713 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 4.6 mt -57.83 -30.78 66.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.986 -0.552 . . . . 75.42 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 180' ' ' LEU . . . . . 0.413 ' HA ' ' HG2' ' A' ' 125' ' ' PRO . 34.4 tp -59.47 -31.01 68.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.39 -0.368 . . . . 73.13 110.84 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.86 1.78 56.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 63.11 111.358 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.48 150.43 36.66 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.834 0.349 . . . . 71.35 110.927 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.57 165.63 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.248 -0.433 . . . . 71.34 111.22 -179.706 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 184' ' ' LYS . . . . . 0.751 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.7 OUTLIER -61.03 117.93 6.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.998 -0.546 . . . . 64.42 110.764 179.859 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 185' ' ' GLY . . . . . 0.405 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 69.35 65.95 2.42 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.678 -0.772 . . . . 70.54 112.272 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 186' ' ' GLU . . . . . 0.503 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 28.0 tt0 -144.48 145.09 31.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.62 0.248 . . . . 75.01 110.403 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt -118.63 137.02 53.57 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.21 -0.293 . . . . 71.42 110.21 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.21 173.79 11.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.18 0.514 . . . . 71.41 111.966 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.73 125.32 22.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.479 -0.782 . . . . 72.04 109.607 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 190' ' ' LEU . . . . . 0.538 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.7 pt? -137.2 143.13 42.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.274 0.559 . . . . 52.1 112.352 -179.122 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 191' ' ' GLU . . . . . 0.857 ' HG2' HG23 ' A' ' 215' ' ' THR . 6.6 mt-10 -117.13 111.01 18.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.289 -0.868 . . . . 74.45 109.862 179.158 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 192' ' ' ILE . . . . . 0.449 HD12 HD11 ' A' ' 172' ' ' ILE . 23.5 mt -104.76 141.52 20.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.024 0.44 . . . . 72.21 111.657 -179.116 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -74.02 163.23 69.82 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.758 -0.656 . . . . 74.12 110.947 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 194' ' ' PRO . . . . . 0.437 ' HG3' ' N ' ' A' ' 212' ' ' ALA . 48.7 Cg_exo -56.33 -36.31 96.92 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.756 2.304 . . . . 72.13 112.382 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -57.26 -42.32 81.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.26 -0.427 . . . . 72.52 111.13 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 196' ' ' TRP . . . . . 0.445 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 20.2 m0 -97.58 36.92 1.43 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 74.15 110.933 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 197' ' ' ALA . . . . . 0.438 ' HA ' HG21 ' A' ' 172' ' ' ILE . . . -160.24 -79.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.989 -0.55 . . . . 73.41 110.587 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 198' ' ' TYR . . . . . 0.582 ' CD2' HD11 ' A' ' 214' ' ' LEU . 42.6 m-85 -105.86 -71.24 0.75 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 60.14 110.352 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.19 178.13 16.16 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.831 -0.7 . . . . 74.14 112.818 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.27 -33.51 67.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.879 0.371 . . . . 72.32 110.86 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.13 -57.02 14.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.107 -0.497 . . . . 72.42 110.633 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.17 170.19 25.02 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.862 -0.685 . . . . 75.13 112.548 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 203' ' ' GLN . . . . . 0.603 ' CB ' HD12 ' A' ' 208' ' ' ILE . 2.5 mm-40 -106.48 85.69 1.86 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.726 0.298 . . . . 74.23 110.698 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -63.4 -21.74 71.35 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.572 2.182 . . . . 52.12 112.554 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.59 -42.28 74.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.877 0.37 . . . . 75.24 110.876 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -97.67 28.21 3.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.096 -0.502 . . . . 71.11 111.306 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 56.01 36.51 27.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.394 -0.366 . . . . 73.3 111.013 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 208' ' ' ILE . . . . . 0.603 HD12 ' CB ' ' A' ' 203' ' ' GLN . 40.9 mt -103.94 114.24 64.69 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.151 -0.477 . . . . 70.44 111.045 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.66 171.72 10.41 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.442 2.095 . . . . 74.25 112.364 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.96 128.62 14.25 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.607 2.205 . . . . 72.41 112.426 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 211' ' ' ASN . . . . . 0.418 ' HA ' ' HG2' ' A' ' 194' ' ' PRO . 5.4 m120 64.26 69.79 0.51 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.127 -0.488 . . . . 71.13 111.0 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 212' ' ' ALA . . . . . 0.437 ' N ' ' HG3' ' A' ' 194' ' ' PRO . . . -127.85 124.91 38.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 65.54 111.493 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 213' ' ' LYS . . . . . 0.501 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.7 OUTLIER -65.19 153.94 39.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 74.55 110.365 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 214' ' ' LEU . . . . . 0.582 HD11 ' CD2' ' A' ' 198' ' ' TYR . 8.5 mt -131.14 109.49 10.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.947 0.403 . . . . 71.24 111.842 -179.264 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 215' ' ' THR . . . . . 0.857 HG23 ' HG2' ' A' ' 191' ' ' GLU . 25.4 m -100.99 135.98 41.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 61.14 110.32 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 216' ' ' PHE . . . . . 0.555 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 21.1 p90 -153.96 173.46 15.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.112 0.482 . . . . 74.11 111.653 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -132.61 136.37 46.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.637 -0.71 . . . . 72.13 110.426 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 218' ' ' VAL . . . . . 0.608 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.1 t -123.83 151.49 28.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.07 0.462 . . . . 72.43 111.968 -178.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -136.83 110.71 8.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.696 -0.683 . . . . 72.24 110.292 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 220' ' ' LEU . . . . . 0.751 HD22 ' HA ' ' A' ' 184' ' ' LYS . 1.7 tt -70.05 131.08 43.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 72.02 111.102 -179.693 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 221' ' ' VAL . . . . . 0.41 HG23 ' HA ' ' A' ' 133' ' ' CYS . 20.1 t -110.34 -29.21 2.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.112 -0.494 . . . . 75.53 111.452 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 222' ' ' ASP . . . . . 0.413 ' N ' HD23 ' A' ' 220' ' ' LEU . 4.1 t70 -170.81 161.31 7.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.917 0.389 . . . . 74.42 111.069 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 223' ' ' ILE . . . . . 0.716 HG13 HD21 ' A' ' 220' ' ' LEU . 42.3 mt -141.02 111.01 3.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.078 -0.51 . . . . 73.33 111.116 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 224' ' ' ASP . . . . . 0.417 ' C ' HG22 ' A' ' 130' ' ' VAL . 1.5 t70 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 74.2 110.907 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 mtm . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.81 0.338 . . . . 74.21 111.184 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.56 ' HB1' HH22 ' A' ' 189' ' ' ARG . . . -175.05 96.58 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 62.15 111.092 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -175.29 76.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 70.35 111.089 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.465 ' HB2' ' HB ' ' A' ' 215' ' ' THR . . . -82.57 175.91 9.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 71.3 111.096 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.984 HG11 HG21 ' A' ' 136' ' ' THR . 38.5 t -60.19 111.1 3.47 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 64.25 111.042 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.46 ' HB2' ' CE1' ' A' ' 32' ' ' HIS . 76.7 Cg_endo -77.75 137.35 15.98 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.564 2.176 . . . . 70.32 112.36 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.749 ' CD ' HD11 ' A' ' 149' ' ' ILE . 1.4 tp60 -82.41 153.66 25.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 75.31 110.87 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.8 119.91 5.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.219 -0.446 . . . . 63.54 111.072 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.498 ' HB2' ' NZ ' ' A' ' 187' ' ' LYS . . . -90.97 -34.22 15.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 42.45 110.988 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.567 ' NE1' HD11 ' A' ' 20' ' ' LEU . 1.4 m-90 -113.95 173.17 6.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.141 -0.482 . . . . 74.04 110.943 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.459 ' O ' HD12 ' A' ' 15' ' ' LEU . 4.1 m -118.4 154.5 32.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.018 -0.537 . . . . 74.51 110.719 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.408 HG13 ' CD ' ' A' ' 16' ' ' ARG . 93.1 t -57.47 -35.52 50.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.939 0.4 . . . . 73.23 110.65 179.753 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -70.19 -28.51 65.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 72.34 111.068 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -82.18 -56.79 3.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.871 0.367 . . . . 74.31 111.098 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.692 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.6 mt -49.6 -64.59 0.76 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.2 -0.454 . . . . 72.41 111.23 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.876 ' HD2' HG11 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -54.04 -25.48 21.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.49 . . . . 73.13 111.182 -179.897 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.7 173.95 0.08 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.957 0.408 . . . . 73.2 111.313 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -110.37 16.93 21.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.865 -0.607 . . . . 71.11 111.182 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -109.8 -20.83 12.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.544 -0.298 . . . . 54.34 111.218 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.763 HD22 HD11 ' A' ' 25' ' ' ILE . 10.4 tt -91.85 129.78 40.94 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.521 -0.309 . . . . 74.23 110.943 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.89 126.33 11.83 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.396 2.064 . . . . 72.45 112.309 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -24.11 67.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 72.23 111.178 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.553 ' HA ' HD12 ' A' ' 26' ' ' ILE . 26.0 mmtt -52.84 -39.25 62.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.359 -0.382 . . . . 73.54 111.374 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.39 -57.6 4.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.272 -0.422 . . . . 64.12 111.04 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.763 HD11 HD22 ' A' ' 20' ' ' LEU . 36.2 mt -44.8 -30.67 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.61 . . . . 65.11 111.479 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.662 ' HB ' HG23 ' A' ' 47' ' ' ILE . 7.1 mt -77.86 -37.33 23.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 74.12 111.008 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -75.37 -24.87 57.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.096 -0.502 . . . . 75.02 111.069 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.489 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 11.8 t80 -72.04 -44.98 62.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.971 0.415 . . . . 63.54 110.837 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.753 HD13 HD13 ' A' ' 43' ' ' LEU . 6.3 mt -68.93 -27.49 65.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 72.32 110.981 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -75.39 -26.57 58.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.271 -0.422 . . . . 70.15 111.127 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.401 ' OE2' ' CD2' ' A' ' 32' ' ' HIS . 0.6 OUTLIER -100.94 -7.2 23.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.413 -0.358 . . . . 71.34 111.317 179.953 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.489 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 10.4 m170 -118.88 -8.73 10.24 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.63 -0.259 . . . . 63.04 111.371 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -123.64 164.74 16.66 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.782 -0.723 . . . . 41.42 112.375 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.7 p -93.21 156.94 16.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.635 0.255 . . . . 71.24 110.535 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.679 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.8 p-10 -48.18 -55.4 10.5 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.745 0.307 . . . . 74.14 111.086 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.7 m -50.47 -48.14 56.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.023 0.439 . . . . 74.34 110.786 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.91 ' CZ ' HD12 ' A' ' 66' ' ' LEU . 1.6 t80 -55.83 -48.66 75.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.842 -0.617 . . . . 75.21 110.44 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.429 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 13.2 mt -66.47 -42.85 86.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.007 -0.542 . . . . 72.21 110.798 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.798 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.39 -41.87 20.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.098 0.475 . . . . 65.31 110.969 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -49.37 -51.44 34.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.623 -0.717 . . . . 74.24 111.062 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -99.95 13.22 34.65 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.98 -0.555 . . . . 70.44 111.287 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt 55.91 41.81 29.54 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.86 0.362 . . . . 74.31 110.862 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.753 HD13 HD13 ' A' ' 29' ' ' LEU . 23.3 mt -92.51 -20.45 20.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.073 -0.512 . . . . 50.31 111.491 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.798 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -80.19 157.72 26.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.122 0.487 . . . . 74.34 111.171 -179.741 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.72 -119.9 4.65 Favored Glycine 0 N--CA 1.451 -0.357 0 CA-C-N 115.608 -0.724 . . . . 61.13 112.417 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.883 ' O ' HG23 ' A' ' 50' ' ' VAL . 17.4 m-80 -116.36 115.14 25.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.72 0.295 . . . . 70.25 110.947 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.662 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.75 -57.22 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.248 -0.433 . . . . 72.11 111.365 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.3 mttt -46.71 -37.23 8.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.87 -0.604 . . . . 65.53 110.944 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -85.7 -26.24 26.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.97 -0.559 . . . . 74.2 111.019 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.6 t -81.21 -26.0 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.411 . . . . 51.11 111.371 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.63 -15.69 63.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.436 -0.347 . . . . 51.45 111.164 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.9 ttpp -95.12 -31.32 13.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.307 -0.406 . . . . 75.33 110.919 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.11 -33.63 17.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 65.43 111.142 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.68 127.25 38.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.264 -0.425 . . . . 52.23 111.163 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -83.49 175.89 9.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 73.55 110.663 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.586 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -58.21 -58.12 9.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.88 0.372 . . . . 75.35 110.595 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.43 -27.81 69.55 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.035 -0.529 . . . . 72.31 110.594 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.1 -43.88 98.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.105 -0.498 . . . . 62.43 110.511 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.648 HD21 HG12 ' A' ' 26' ' ' ILE . 21.1 mt -71.59 -34.45 69.9 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.693 -0.685 . . . . 64.02 111.06 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.876 HG11 ' HD2' ' A' ' 16' ' ' ARG . 11.1 t -76.4 -41.9 35.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.017 0.437 . . . . 63.34 110.922 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.7 m -60.54 -34.26 73.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.892 -0.595 . . . . 73.2 110.654 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.428 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -81.02 -22.12 39.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 74.31 111.138 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.682 ' HA ' HD21 ' A' ' 29' ' ' LEU . 32.4 t80 -83.59 -22.84 32.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.295 -0.412 . . . . 62.31 111.079 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -84.46 -54.24 4.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 71.42 111.49 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 3.1 p-80 -62.08 -32.9 73.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.073 -0.512 . . . . 63.23 111.288 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.91 HD12 ' CZ ' ' A' ' 37' ' ' PHE . 8.3 tt -47.69 -40.52 20.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.887 0.375 . . . . 74.43 111.201 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -78.14 -38.06 44.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.061 -0.518 . . . . 70.02 110.598 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.77 -38.45 86.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.992 -0.549 . . . . 61.15 110.823 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.1 p -87.85 -7.08 57.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 75.51 111.526 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.46 ' HZ2' ' HE1' ' A' ' 72' ' ' PHE . 0.8 OUTLIER 47.65 41.13 13.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.707 0.289 . . . . 70.5 111.556 179.61 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -107.34 46.04 0.96 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.91 0.386 . . . . 72.05 110.845 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.647 ' CD2' HD21 ' A' ' 66' ' ' LEU . 88.3 m-85 -60.58 179.07 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.014 -0.539 . . . . 74.4 110.741 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 41.2 tttm -65.54 135.98 55.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 61.13 110.798 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -113.28 179.99 19.16 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.746 -0.74 . . . . 63.13 112.497 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.758 HG23 ' CG2' ' A' ' 78' ' ' ILE . 69.4 m -61.58 139.15 58.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.834 0.349 . . . . 74.54 110.871 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -145.18 -46.91 0.23 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 74.43 110.943 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.419 ' O ' ' CG1' ' A' ' 78' ' ' ILE . 3.6 m -128.89 -45.2 1.29 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.025 -0.534 . . . . 53.51 110.963 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.758 ' CG2' HG23 ' A' ' 75' ' ' THR . 38.1 pt 45.1 -171.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.893 -0.594 . . . . 74.32 111.699 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 50.1 m -82.44 131.33 35.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.352 -0.386 . . . . 63.42 110.87 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.9 mtpm? -155.75 115.9 3.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 52.14 110.939 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 31.6 m -107.07 -32.3 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 62.52 111.1 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.7 p -173.86 176.51 2.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.438 . . . . 73.14 110.905 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -144.24 118.26 9.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.459 . . . . 51.15 110.871 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -128.28 146.94 50.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 72.43 110.943 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -134.73 104.49 5.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.259 -0.428 . . . . 73.44 111.095 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.02 144.67 56.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 72.4 110.847 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -92.87 111.42 23.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 72.42 110.915 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.5 t 63.85 90.99 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 65.21 111.133 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -173.66 -41.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.434 . . . . 71.01 110.915 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.6 tp 56.84 100.4 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.015 -0.539 . . . . 64.54 111.023 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -156.59 121.68 4.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.235 -0.438 . . . . 75.41 110.935 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 62.65 145.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 73.3 111.029 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -112.77 -34.74 5.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.185 -0.461 . . . . 74.42 110.926 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 16.4 mttm -101.67 158.9 30.9 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 63.14 110.894 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.71 -40.52 73.59 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.583 2.189 . . . . 60.03 112.279 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 56.81 -168.22 0.11 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.023 -0.535 . . . . 65.42 111.005 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 61.03 169.07 0.1 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 71.24 110.919 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.566 HG22 ' O ' ' A' ' 98' ' ' THR . 28.7 m -163.63 34.05 0.09 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 74.14 110.868 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 64.51 -79.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 75.04 110.9 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 26.5 m -60.13 146.41 43.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.132 -0.485 . . . . 71.32 110.864 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -144.08 78.63 1.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 70.22 110.892 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -176.65 92.7 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 64.02 110.873 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 8.8 p -106.24 -33.13 7.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 61.43 110.885 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.494 HD23 ' H ' ' A' ' 107' ' ' GLY . 0.5 OUTLIER -166.24 173.96 9.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 74.22 110.915 179.953 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -110.05 -31.02 7.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 64.44 110.971 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -89.64 -31.9 17.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 73.01 110.927 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.494 ' H ' HD23 ' A' ' 104' ' ' LEU . . . 111.07 109.55 3.14 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.736 -0.745 . . . . 52.41 112.394 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.61 162.03 40.98 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.46 2.106 . . . . 45.32 112.306 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.451 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 39.8 Cg_exo -57.15 -160.64 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.647 2.232 . . . . 72.01 112.353 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -97.2 37.7 1.31 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.213 -0.449 . . . . 74.31 111.0 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.451 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 21.0 p90 -165.68 166.86 17.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 75.35 110.906 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.456 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 0.3 OUTLIER -134.03 127.66 32.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.479 . . . . 71.42 110.546 179.807 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.01 144.51 49.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.951 0.405 . . . . 74.21 111.231 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.443 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.3 m -143.16 115.34 8.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.004 -0.544 . . . . 63.42 110.71 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 24.2 t -74.61 106.27 4.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.292 -0.413 . . . . 74.33 111.331 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.443 HD12 ' O ' ' A' ' 114' ' ' SER . 6.0 mp -74.04 -63.06 1.3 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 72.45 110.758 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.6 108.07 16.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 70.23 110.878 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.78 140.79 54.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.222 -0.445 . . . . 75.35 110.98 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.509 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -112.37 -154.38 12.17 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.795 -0.717 . . . . 74.33 112.404 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -36.8 -51.9 0.9 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.956 0.408 . . . . 73.3 111.446 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.7 tttm 69.69 35.64 2.34 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.908 -0.587 . . . . 73.12 110.197 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.27 -44.76 0.09 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.702 -0.681 . . . . 73.22 110.724 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -89.08 89.44 7.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 63.42 110.843 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -97.61 154.72 37.83 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.479 . . . . 75.04 110.909 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.79 ' HB2' HG21 ' A' ' 166' ' ' VAL . 56.4 Cg_endo -70.41 125.59 11.97 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.577 2.185 . . . . 52.13 112.356 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -99.75 153.22 19.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 74.11 110.914 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.55 116.9 5.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.245 -0.434 . . . . 75.31 110.856 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 107.42 -23.21 27.21 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.715 -0.755 . . . . 71.42 112.517 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.38 139.73 30.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.771 0.319 . . . . 74.25 110.732 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.612 HG12 ' HG3' ' A' ' 165' ' ' LYS . 16.9 m -70.84 174.32 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.035 0.445 . . . . 75.52 111.432 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.874 HG22 ' O ' ' A' ' 164' ' ' PHE . 20.7 m -157.51 145.49 10.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.66 -0.7 . . . . 64.04 110.387 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.536 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -127.22 117.72 22.88 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.722 0.296 . . . . 75.42 110.683 179.815 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.491 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 27.3 p -155.2 170.86 20.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.027 0.441 . . . . 62.22 111.191 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.811 ' HB3' HD13 ' A' ' 149' ' ' ILE . 8.8 m95 -106.37 163.64 12.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.84 -0.618 . . . . 75.11 110.21 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.465 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 35.8 p90 -160.97 135.18 7.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.129 0.49 . . . . 71.41 111.751 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.984 HG21 HG11 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -124.41 110.7 14.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.612 -0.722 . . . . 74.53 110.137 179.421 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.611 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.61 144.27 17.07 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.565 -0.826 . . . . 71.32 113.468 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.844 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -151.72 130.26 12.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.681 0.277 . . . . 52.14 110.385 179.596 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.633 HD12 ' HB ' ' A' ' 143' ' ' THR . 35.3 mt -60.93 -178.32 0.1 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.445 -0.343 . . . . 73.32 110.841 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -56.04 -41.48 75.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 74.23 110.746 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -83.56 -0.57 50.94 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.979 -0.555 . . . . 75.03 111.474 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 93.79 25.79 16.75 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.64 -0.791 . . . . 62.31 112.637 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' THR . . . . . 0.633 ' HB ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -81.12 111.48 17.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.76 0.314 . . . . 72.21 110.874 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.425 HG21 ' HE3' ' A' ' 70' ' ' LYS . 34.9 t -65.59 120.91 13.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 61.2 111.17 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.443 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 35.2 p90 -112.13 -24.71 9.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 75.45 111.06 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ASP . . . . . 0.414 ' HB2' ' CE1' ' A' ' 145' ' ' PHE . 28.9 m-20 -161.89 113.37 1.69 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.427 -0.351 . . . . 74.51 110.94 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.962 HG23 HG23 ' A' ' 136' ' ' THR . 90.0 m -125.29 105.58 9.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 73.42 111.04 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.465 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 27.4 t-20 -88.73 -0.62 57.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 73.31 111.27 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.811 HD13 ' HB3' ' A' ' 134' ' ' TRP . 21.7 mm -70.7 85.3 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.757 0.313 . . . . 72.14 110.913 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -74.99 167.93 20.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.283 -0.417 . . . . 64.21 110.893 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' THR . . . . . 0.606 ' O ' ' HB2' ' A' ' 159' ' ' ALA . 17.3 p -59.38 166.02 2.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 70.13 110.959 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 12.0 p -75.13 150.19 38.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 75.43 110.901 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.06 -27.28 35.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.469 . . . . 72.14 111.249 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.97 -31.12 64.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.275 -0.421 . . . . 62.33 110.983 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.17 -29.48 17.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 72.51 110.963 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -173.13 125.48 0.43 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 71.14 110.897 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 13.7 mmtt -59.86 94.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 62.34 110.887 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -165.65 42.72 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 61.42 110.885 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.606 ' HB2' ' O ' ' A' ' 151' ' ' THR . . . -141.65 121.94 13.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 54.34 111.094 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -146.38 112.53 4.37 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 52.55 110.844 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.426 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 67.1 Cg_exo -51.01 154.02 7.97 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.422 2.081 . . . . 72.42 112.328 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.428 HD23 ' HD1' ' A' ' 164' ' ' PHE . 3.2 tt -78.35 122.37 25.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 65.01 110.522 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.67 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -100.42 121.35 41.4 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.94 0.4 . . . . 74.54 111.236 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.874 ' O ' HG22 ' A' ' 131' ' ' VAL . 10.1 p90 -150.1 141.74 23.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.98 -0.555 . . . . 74.31 110.731 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.612 ' HG3' HG12 ' A' ' 130' ' ' VAL . 72.6 mttt -77.33 136.63 38.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.083 0.468 . . . . 75.23 111.201 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.79 HG21 ' HB2' ' A' ' 125' ' ' PRO . 32.0 m -87.64 149.38 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.704 -0.68 . . . . 73.54 111.185 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.83 24.09 75.65 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.912 -0.661 . . . . 73.21 112.673 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.785 HG23 ' HG2' ' A' ' 170' ' ' LYS . 14.4 m -132.27 44.77 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.914 0.388 . . . . 61.13 111.043 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.7 36.39 4.67 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 121.188 -0.529 . . . . 72.52 113.215 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' LYS . . . . . 0.785 ' HG2' HG23 ' A' ' 168' ' ' VAL . 3.0 mmtm -82.99 -47.11 12.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.941 0.401 . . . . 61.21 110.983 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -118.3 -179.65 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.963 -0.562 . . . . 75.2 110.992 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.542 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -58.82 159.54 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 75.33 111.23 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -68.25 -26.1 65.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 71.44 111.297 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -77.84 -37.06 30.75 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.669 -0.777 . . . . 51.13 112.198 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.599 ' CD1' HD11 ' A' ' 190' ' ' LEU . 2.4 t90 -77.3 -33.57 55.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.897 0.38 . . . . 73.33 111.17 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.96 -37.16 83.76 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.016 -0.538 . . . . 74.14 110.617 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -73.27 -30.07 63.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.016 -0.538 . . . . 64.51 110.731 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.736 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -83.4 -48.82 9.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.147 -0.479 . . . . 62.31 111.249 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.57 HD21 HG21 ' A' ' 218' ' ' VAL . 9.4 mt -63.47 -34.42 77.72 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.074 -0.512 . . . . 61.45 110.801 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 35.6 tp -55.71 -23.12 27.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 74.42 111.115 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 51.1 p -98.64 2.25 47.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.368 -0.378 . . . . 61.21 111.567 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.413 ' HE1' ' O ' ' A' ' 186' ' ' GLU . 0.0 OUTLIER -77.19 152.39 34.82 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.729 0.299 . . . . 65.44 110.737 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -115.43 161.99 17.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.31 -0.405 . . . . 45.31 111.259 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -60.05 122.51 14.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.94 -0.573 . . . . 74.31 110.461 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 66.72 60.41 6.19 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.556 -0.83 . . . . 54.52 112.373 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 186' ' ' GLU . . . . . 0.509 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 17.1 tt0 -141.58 148.28 39.03 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.306 -0.257 . . . . 74.34 110.306 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 187' ' ' LYS . . . . . 0.498 ' NZ ' ' HB2' ' A' ' 9' ' ' ALA . 9.9 ttpt -117.26 135.61 53.69 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.184 -0.302 . . . . 74.31 110.184 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.73 168.9 18.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.126 0.489 . . . . 75.44 111.809 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 189' ' ' ARG . . . . . 0.56 HH22 ' HB1' ' A' ' 2' ' ' ALA . 0.1 OUTLIER -137.72 101.11 4.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.597 -0.729 . . . . 75.44 109.711 179.139 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.749 HD12 HD11 ' A' ' 192' ' ' ILE . 0.3 OUTLIER -115.34 143.91 44.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.101 0.477 . . . . 74.01 112.06 -178.853 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.687 ' HB3' HG23 ' A' ' 215' ' ' THR . 8.3 pt-20 -118.0 115.07 24.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.603 -0.726 . . . . 74.25 110.531 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.749 HD11 HD12 ' A' ' 190' ' ' LEU . 3.3 mp -96.93 134.79 33.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 74.04 111.247 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -70.89 166.1 40.66 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.912 -0.586 . . . . 73.33 110.808 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.94 -14.42 44.44 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.579 2.186 . . . . 64.32 112.604 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -79.64 -25.71 41.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.68 0.276 . . . . 70.34 111.245 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 196' ' ' TRP . . . . . . . . . . . . . 12.8 m0 -117.1 37.08 3.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.452 -0.34 . . . . 72.01 111.277 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -145.97 -83.46 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.353 -0.385 . . . . 70.24 111.356 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 198' ' ' TYR . . . . . 0.639 ' CE2' HD13 ' A' ' 208' ' ' ILE . 15.8 m-85 -109.43 -34.5 6.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.901 0.381 . . . . 62.33 110.875 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 118.18 170.02 14.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.85 -0.69 . . . . 72.1 112.577 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.89 -29.0 62.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.806 0.336 . . . . 64.12 110.926 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -66.67 -50.69 62.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.224 -0.444 . . . . 73.25 110.856 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 115.31 -162.66 12.4 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.87 -0.681 . . . . 54.11 112.468 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.547 ' HB3' HD12 ' A' ' 208' ' ' ILE . 1.2 tm0? -137.0 77.65 42.78 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.891 0.377 . . . . 52.43 110.863 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.61 -23.23 24.91 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.625 2.216 . . . . 55.42 112.422 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.96 -41.89 79.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.298 -0.41 . . . . 74.01 111.046 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.96 30.4 6.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.088 -0.506 . . . . 73.11 111.126 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.32 35.67 25.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 73.02 110.918 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.639 HD13 ' CE2' ' A' ' 198' ' ' TYR . 32.0 mt -98.53 111.74 60.78 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.454 . . . . 75.34 111.095 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.13 171.11 15.48 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.478 2.119 . . . . 54.41 112.373 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.56 142.12 69.93 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.586 2.19 . . . . 73.21 112.265 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 54.18 69.44 0.72 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.208 -0.451 . . . . 64.22 111.024 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 212' ' ' ALA . . . . . 0.516 ' HB1' HD22 ' A' ' 139' ' ' LEU . . . -122.43 115.02 21.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 63.32 111.466 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -65.35 131.49 46.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.043 -0.526 . . . . 75.53 110.452 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.512 HD11 ' CE2' ' A' ' 198' ' ' TYR . 4.9 mt -113.58 109.41 18.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.896 0.379 . . . . 64.34 111.68 -179.396 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.687 HG23 ' HB3' ' A' ' 191' ' ' GLU . 2.8 m -109.59 140.1 43.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.546 . . . . 73.13 110.417 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.611 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 4.7 p90 -156.32 -179.29 8.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.013 0.435 . . . . 72.54 111.387 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -134.34 137.65 44.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.721 -0.672 . . . . 74.44 110.432 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.573 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.7 t -120.32 151.76 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.99 0.424 . . . . 63.32 111.997 -179.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -136.33 105.87 6.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.777 -0.647 . . . . 72.1 110.221 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.552 HD21 ' CG1' ' A' ' 223' ' ' ILE . 1.0 OUTLIER -69.96 129.5 39.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.343 -0.39 . . . . 70.33 110.845 -179.755 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 33.7 t -108.24 -28.99 2.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.266 -0.424 . . . . 65.3 111.426 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -171.18 162.23 6.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.839 0.352 . . . . 60.14 111.024 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.644 HG23 HG12 ' A' ' 131' ' ' VAL . 46.5 mt -140.75 111.16 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 61.22 111.135 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 224' ' ' ASP . . . . . 0.589 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 64.31 110.817 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 mtm . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.79 0.329 . . . . 70.5 111.208 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -132.44 173.21 11.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 73.41 111.095 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -158.96 97.65 1.42 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 74.21 111.057 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 59.33 96.75 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 72.24 111.131 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.892 HG11 HG21 ' A' ' 136' ' ' THR . 49.1 t -60.18 110.67 3.04 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 52.13 110.952 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.426 ' HD2' ' CE1' ' A' ' 72' ' ' PHE . 85.6 Cg_endo -80.46 145.46 16.67 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.632 2.221 . . . . 70.3 112.426 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -81.28 149.72 28.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.267 -0.424 . . . . 74.23 110.884 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.63 98.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 70.42 111.33 -179.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.429 ' HB2' ' HE3' ' A' ' 187' ' ' LYS . . . -68.58 -19.19 64.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.983 -0.553 . . . . 63.44 111.391 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.599 ' CD1' HD11 ' A' ' 20' ' ' LEU . 2.9 m-90 -136.99 173.89 11.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.96 0.409 . . . . 74.13 110.914 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.45 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.1 OUTLIER -115.64 150.89 35.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.871 -0.604 . . . . 70.25 110.475 179.673 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.541 HG12 ' HD2' ' A' ' 16' ' ' ARG . 32.7 t -56.11 -32.01 32.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.929 0.395 . . . . 72.55 110.818 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -73.98 -26.29 60.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.959 -0.564 . . . . 71.41 111.21 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.45 ' HB2' HG23 ' A' ' 11' ' ' THR . 6.2 mm100 -82.26 -57.27 3.45 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.892 0.377 . . . . 73.0 111.095 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.754 ' HB3' HG22 ' A' ' 60' ' ' VAL . 3.5 mt -49.67 -63.46 1.1 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.153 -0.476 . . . . 64.55 111.158 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.541 ' HD2' HG12 ' A' ' 12' ' ' VAL . 19.7 mtt180 -54.34 -24.42 19.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.125 -0.489 . . . . 65.24 111.217 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.08 176.97 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.944 0.402 . . . . 75.02 111.115 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -110.35 16.69 21.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.941 -0.572 . . . . 73.01 111.13 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -108.34 -28.02 9.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.519 -0.31 . . . . 74.54 111.093 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.599 HD11 ' CD1' ' A' ' 10' ' ' TRP . 7.0 tt -85.9 113.11 49.8 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.334 -0.393 . . . . 71.24 110.967 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -56.39 123.96 15.11 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.401 2.067 . . . . 72.13 112.172 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -24.11 65.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 74.44 111.089 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.7 mmtp -53.7 -33.59 55.96 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.281 -0.418 . . . . 65.12 111.332 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -78.76 -51.87 9.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.966 0.413 . . . . 71.41 110.998 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.552 HD11 HD22 ' A' ' 20' ' ' LEU . 31.1 mt -46.82 -33.17 2.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.896 -0.593 . . . . 74.44 111.311 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.668 HG12 HD21 ' A' ' 59' ' ' LEU . 12.1 mt -74.95 -52.94 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.084 0.468 . . . . 74.53 111.015 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.684 ' HG3' HD11 ' A' ' 47' ' ' ILE . 0.1 OUTLIER -57.01 -22.8 41.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.752 -0.658 . . . . 75.04 111.323 -179.895 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -75.08 -49.37 19.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.966 0.413 . . . . 55.12 110.851 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.891 HD23 HD12 ' A' ' 66' ' ' LEU . 4.3 mt -65.5 -26.63 68.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.914 -0.585 . . . . 75.22 110.938 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -81.27 -27.03 35.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.295 -0.411 . . . . 70.15 111.038 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.426 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -97.09 -6.13 35.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.492 -0.322 . . . . 75.25 111.198 179.714 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.426 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 92.2 m-70 -128.4 -3.23 5.52 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.346 . . . . 70.42 111.484 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.65 157.21 15.58 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.711 -0.757 . . . . 74.41 112.289 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.4 p -92.66 149.89 21.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.624 0.25 . . . . 65.44 110.625 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.938 ' HA ' HD12 ' A' ' 38' ' ' LEU . 0.6 OUTLIER -44.15 -49.77 8.9 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.405 -0.361 . . . . 74.12 111.49 -179.796 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.6 p -55.03 -47.42 74.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.008 0.433 . . . . 55.12 110.506 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.492 ' CE2' ' CE1' ' A' ' 65' ' ' HIS . 4.1 t80 -58.13 -44.12 87.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.692 . . . . 72.41 110.703 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.938 HD12 ' HA ' ' A' ' 35' ' ' ASP . 3.1 mt -63.57 -49.19 74.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.256 -0.429 . . . . 71.04 110.895 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.829 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -49.2 -28.19 4.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.115 -0.493 . . . . 64.14 111.349 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -77.43 -33.1 54.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 60.12 111.218 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.684 ' ND1' ' HB2' ' A' ' 62' ' ' ALA . 6.3 m-70 -108.78 10.42 26.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.395 -0.366 . . . . 74.24 111.58 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' A' ' 38' ' ' LEU . 12.8 mttp 60.21 31.86 20.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.779 0.323 . . . . 65.23 110.992 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.618 HD11 ' HB1' ' A' ' 62' ' ' ALA . 64.5 mt -84.56 -21.12 30.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 73.31 111.054 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.829 HD11 ' HB2' ' A' ' 39' ' ' ALA . 61.7 mt -48.75 170.34 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.944 0.402 . . . . 64.03 111.104 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.27 -163.39 34.26 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.784 -0.722 . . . . 62.41 112.78 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.884 ' O ' HG23 ' A' ' 50' ' ' VAL . 1.7 t-20 -102.85 148.77 25.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.88 0.372 . . . . 74.12 111.016 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.684 HD11 ' HG3' ' A' ' 27' ' ' LYS . 3.1 mp -45.27 -43.29 3.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.015 -0.539 . . . . 70.1 111.498 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -56.44 -42.33 77.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.877 -0.601 . . . . 73.33 111.092 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -85.74 -28.17 24.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.084 -0.507 . . . . 74.53 111.336 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 46' ' ' ASN . 14.2 t -77.41 -26.42 15.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 75.21 111.478 -179.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.55 -25.24 65.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.383 -0.371 . . . . 53.54 111.311 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.3 pttt -95.22 -30.95 13.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.311 -0.404 . . . . 52.31 111.136 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 m -84.98 -22.21 29.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 73.23 111.381 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -113.0 128.7 56.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.828 0.347 . . . . 62.12 111.283 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -78.9 179.89 7.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 74.04 110.447 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.623 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -60.82 -58.48 8.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.84 0.353 . . . . 70.12 110.537 179.96 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.49 -26.38 67.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.109 -0.496 . . . . 63.05 110.6 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.67 -40.4 94.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.114 0.483 . . . . 64.24 110.261 179.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.668 HD21 HG12 ' A' ' 26' ' ' ILE . 17.4 mt -77.42 -30.04 53.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.659 -0.701 . . . . 65.33 111.036 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.754 HG22 ' HB3' ' A' ' 15' ' ' LEU . 17.8 t -79.11 -43.33 24.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.942 0.401 . . . . 65.12 110.752 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 75.4 m -60.05 -34.49 73.49 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.895 -0.593 . . . . 73.44 110.486 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.684 ' HB2' ' ND1' ' A' ' 41' ' ' HIS . . . -82.01 -21.72 36.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.006 -0.543 . . . . 52.42 110.898 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.769 ' HA ' HD21 ' A' ' 29' ' ' LEU . 16.3 t80 -83.79 -22.78 31.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 72.31 110.97 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -85.07 -54.33 4.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.136 -0.483 . . . . 62.21 111.479 -179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.492 ' CE1' ' CE2' ' A' ' 37' ' ' PHE . 2.9 p-80 -62.08 -25.34 67.64 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.16 -0.473 . . . . 74.34 111.385 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.891 HD12 HD23 ' A' ' 29' ' ' LEU . 3.4 tt -53.65 -39.89 65.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.967 0.413 . . . . 74.04 110.945 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.401 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.2 m-85 -79.06 -39.88 32.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.93 -0.577 . . . . 64.42 110.641 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.1 -40.31 90.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.985 -0.552 . . . . 71.1 110.957 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 57.9 p -88.06 -9.77 52.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.033 -0.53 . . . . 74.45 111.413 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.21 33.63 12.87 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.763 0.316 . . . . 72.14 111.192 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 66.6 mtt-85 -92.52 46.18 1.23 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.356 -0.384 . . . . 65.34 111.019 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.562 ' CE1' HD22 ' A' ' 66' ' ' LEU . 91.9 m-85 -67.17 175.8 2.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 65.43 110.856 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 49.4 tttt -73.07 152.98 41.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.352 -0.385 . . . . 74.12 110.882 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -157.4 127.57 1.95 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.738 -0.744 . . . . 72.25 112.569 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.2 p 57.92 107.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.829 0.347 . . . . 62.24 110.95 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -176.01 -39.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 64.13 110.94 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.551 ' O ' HG23 ' A' ' 78' ' ' ILE . 19.6 p -139.39 117.53 11.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.09 -0.505 . . . . 75.44 110.9 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.551 HG23 ' O ' ' A' ' 77' ' ' SER . 9.2 pt -159.02 -42.55 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.175 -0.466 . . . . 62.12 111.24 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 70.4 m 60.57 111.06 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.153 -0.476 . . . . 62.35 110.881 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 29.7 mttt -134.48 126.01 28.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 54.22 110.891 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.562 HG22 ' O ' ' A' ' 81' ' ' VAL . 10.3 p -92.24 52.36 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 74.34 111.046 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 65.7 m -152.97 149.31 28.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.11 -0.495 . . . . 72.13 110.902 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -100.97 -42.58 6.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 61.32 110.847 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 59.32 99.04 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.002 -0.545 . . . . 72.04 110.953 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t 59.28 88.41 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.47 . . . . 74.42 111.174 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.5 mmtt -151.02 -176.63 5.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.449 . . . . 60.24 110.962 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -89.67 141.13 28.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 53.44 110.854 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 12.5 p -68.64 137.65 23.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 74.11 111.102 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.4 tttp -175.74 -40.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 73.4 110.946 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -128.03 136.67 51.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.092 -0.504 . . . . 71.3 110.93 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -128.25 132.66 48.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 62.21 110.876 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -83.83 158.03 21.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 73.45 110.935 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.34 -34.1 7.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 52.53 110.91 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -173.18 150.66 1.94 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 70.02 110.898 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.52 -172.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.54 2.16 . . . . 72.12 112.287 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -177.29 -39.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 75.11 110.936 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -103.1 133.96 47.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 74.32 110.935 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.8 t -130.1 141.48 50.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 74.04 110.926 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -108.03 -179.18 3.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 64.42 110.891 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 57.4 m 62.76 -80.56 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.152 -0.476 . . . . 60.42 111.015 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 60.29 35.7 20.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.239 -0.437 . . . . 75.1 110.961 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -102.87 111.48 23.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.173 -0.467 . . . . 62.05 110.88 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 73.3 p -78.96 145.15 34.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 73.43 110.908 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.1 mp -138.98 -178.12 5.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 52.0 110.925 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -81.6 -177.62 6.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 73.41 110.894 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -89.85 97.73 11.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.449 . . . . 74.01 110.919 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 91.48 52.48 2.32 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.728 -0.749 . . . . 62.45 112.552 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.16 171.46 14.85 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.601 2.201 . . . . 65.15 112.307 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.34 -176.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.574 2.183 . . . . 65.14 112.252 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.442 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.1 OUTLIER -103.07 28.69 6.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 60.11 110.959 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 30.8 p90 -149.46 162.23 40.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 75.02 110.819 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 5.8 m -132.0 103.55 6.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 75.43 111.058 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.408 ' CB ' ' HB3' ' A' ' 190' ' ' LEU . 0.8 OUTLIER -111.09 145.16 39.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.207 -0.451 . . . . 65.31 110.797 179.915 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.425 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.5 m -137.97 130.77 29.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 75.11 110.941 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 22.1 t -80.47 106.32 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 50.12 111.14 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.433 HD13 ' HA ' ' A' ' 188' ' ' ALA . 7.4 mp -76.28 -50.01 15.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.224 -0.444 . . . . 75.02 110.768 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.85 111.55 16.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.089 -0.505 . . . . 74.21 110.902 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.95 142.35 46.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 75.11 110.904 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.488 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -114.57 -155.78 11.27 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.741 -0.742 . . . . 23.4 112.615 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -37.21 -52.43 1.05 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.013 0.435 . . . . 72.5 111.415 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 71.22 35.84 1.49 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.789 -0.642 . . . . 73.2 110.178 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 57.2 m -152.98 -43.81 0.1 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.712 -0.676 . . . . 73.23 110.692 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -92.73 95.85 9.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 72.2 110.838 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -107.41 146.12 32.64 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.138 -0.483 . . . . 61.2 110.756 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -56.35 125.34 18.75 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.429 2.086 . . . . 73.32 112.454 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.02 150.37 22.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.981 -0.554 . . . . 63.32 110.909 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -53.93 114.18 1.49 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.42 . . . . 72.34 110.856 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.14 -23.62 33.87 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.58 -0.819 . . . . 53.43 112.356 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.673 ' O ' HG22 ' A' ' 166' ' ' VAL . 0.6 OUTLIER -81.58 135.59 35.56 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.817 0.341 . . . . 73.4 110.628 179.877 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.575 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 12.8 m -73.62 175.78 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.284 0.564 . . . . 44.33 111.795 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.719 HG12 HG23 ' A' ' 223' ' ' ILE . 20.5 m -157.29 146.37 10.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.247 -0.888 . . . . 71.24 110.509 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.627 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -125.43 117.29 23.35 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.983 -0.287 . . . . 72.31 110.624 179.623 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.483 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 30.9 p -153.97 167.07 30.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.951 0.405 . . . . 75.52 111.151 -179.368 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.629 ' HB3' HD11 ' A' ' 149' ' ' ILE . 62.2 m95 -99.67 160.73 14.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.922 -0.581 . . . . 75.44 110.074 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 34.3 p90 -158.63 134.97 9.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.102 0.477 . . . . 73.41 111.747 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.906 HG23 HG23 ' A' ' 147' ' ' THR . 0.2 OUTLIER -126.89 111.67 14.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.72 -0.673 . . . . 63.54 110.188 179.392 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.591 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.66 144.04 17.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.562 -0.828 . . . . 62.14 113.27 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.71 HG23 HG13 ' A' ' 144' ' ' VAL . 0.2 OUTLIER -150.62 142.11 23.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.806 0.336 . . . . 63.35 110.554 179.642 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.68 HD12 ' HB ' ' A' ' 143' ' ' THR . 87.7 mt -77.96 -178.21 5.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.262 -0.426 . . . . 74.5 110.93 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -58.86 -43.33 90.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.296 -0.411 . . . . 72.23 110.895 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -75.82 -4.72 42.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.96 -0.564 . . . . 55.25 111.448 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' GLY . . . . . 0.533 ' C ' HG22 ' A' ' 138' ' ' THR . . . 92.61 23.07 27.05 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.679 -0.772 . . . . 74.11 112.655 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' THR . . . . . 0.68 ' HB ' HD12 ' A' ' 139' ' ' LEU . 1.3 m -88.28 108.31 19.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.811 0.339 . . . . 62.03 110.776 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.71 HG13 HG23 ' A' ' 138' ' ' THR . 3.7 m -71.16 132.64 33.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 60.43 111.275 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -112.19 -31.19 6.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 63.51 110.895 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -143.83 123.03 12.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 73.34 110.98 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.906 HG23 HG23 ' A' ' 136' ' ' THR . 82.9 m -137.45 105.69 5.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 61.13 110.72 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.525 ' C ' HD12 ' A' ' 149' ' ' ILE . 52.6 t30 -86.17 12.6 9.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 74.55 111.702 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.684 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.6 mp -115.78 118.91 60.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 120.83 0.348 . . . . 71.24 110.903 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -123.8 -67.68 0.92 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 74.03 110.902 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 70.1 p -126.9 166.01 18.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 53.15 110.937 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.7 m -84.03 167.82 16.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.462 . . . . 64.21 110.915 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -80.98 -30.74 35.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 73.24 111.164 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 3.8 mtmt -59.72 -33.22 71.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.439 . . . . 75.23 110.926 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.3 -34.94 71.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 75.14 110.833 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.64 -179.18 0.79 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 60.54 110.808 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 4.0 tptt -99.05 31.41 3.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.475 . . . . 73.43 110.898 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -104.72 31.39 4.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 72.22 110.95 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -152.79 119.25 5.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 63.4 111.081 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -146.56 148.22 33.12 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 72.14 110.779 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.84 156.68 65.0 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.474 2.116 . . . . 44.02 112.233 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.2 128.02 32.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.083 -0.508 . . . . 61.04 110.746 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.627 ' HB3' ' CD2' ' A' ' 132' ' ' HIS . 0.6 OUTLIER -105.41 126.68 52.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.27 -0.423 . . . . 62.03 111.054 179.817 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.694 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 19.3 p90 -151.0 140.94 21.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 75.31 110.977 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.616 ' CB ' HG21 ' A' ' 168' ' ' VAL . 10.3 mtpt -69.65 131.25 44.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.333 -0.394 . . . . 64.21 110.828 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.673 HG22 ' O ' ' A' ' 129' ' ' ASP . 34.4 m -87.88 149.21 4.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 55.33 111.182 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 67.99 25.09 74.46 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.764 -0.732 . . . . 61.43 112.595 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.616 HG21 ' CB ' ' A' ' 165' ' ' LYS . 15.7 m -134.24 46.17 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.9 0.381 . . . . 75.05 111.121 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.59 35.52 3.0 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.212 -0.518 . . . . 72.43 113.276 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 170' ' ' LYS . . . . . 0.43 ' CG ' HG23 ' A' ' 168' ' ' VAL . 0.0 OUTLIER -82.15 -47.08 12.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.887 0.375 . . . . 72.12 111.056 -179.91 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 171' ' ' VAL . . . . . 0.443 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.8 OUTLIER -118.48 -179.58 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.049 -0.523 . . . . 61.03 110.971 179.829 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.539 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.22 158.39 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.453 -0.34 . . . . 72.31 111.197 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 23.5 ttm180 -66.52 -28.57 68.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.295 -0.411 . . . . 72.1 111.301 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.48 -36.53 43.72 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.659 -0.781 . . . . 63.21 112.16 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.745 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.3 t90 -78.99 -34.37 44.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.916 0.388 . . . . 64.33 111.096 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -62.46 -38.01 88.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 64.14 110.423 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 177' ' ' GLU . . . . . 0.551 ' O ' HG23 ' A' ' 181' ' ' THR . 2.9 mm-40 -75.45 -29.82 59.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.986 -0.552 . . . . 53.54 110.644 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.634 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -78.76 -58.32 3.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.153 -0.476 . . . . 70.35 111.128 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.694 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 5.8 mt -56.73 -34.38 67.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.983 -0.553 . . . . 51.34 110.898 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 16.4 tp -59.91 -30.34 68.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.248 -0.433 . . . . 64.25 110.694 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 181' ' ' THR . . . . . 0.551 HG23 ' O ' ' A' ' 177' ' ' GLU . 32.5 p -87.11 -3.58 59.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 63.33 111.291 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 71.4 mmm -78.17 154.3 31.27 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.794 0.33 . . . . 70.23 110.718 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 10.4 p -121.19 170.33 9.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 54.42 111.175 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 184' ' ' LYS . . . . . 0.676 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -61.94 117.43 5.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.011 -0.541 . . . . 72.24 110.776 179.876 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 185' ' ' GLY . . . . . 0.407 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 70.48 66.82 2.08 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.701 -0.762 . . . . 31.44 112.224 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 186' ' ' GLU . . . . . 0.488 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 19.0 tt0 -146.02 147.25 31.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.636 0.255 . . . . 74.44 110.563 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 187' ' ' LYS . . . . . 0.429 ' HE3' ' HB2' ' A' ' 9' ' ' ALA . 2.8 ttpm? -121.98 136.54 54.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.761 0.315 . . . . 72.12 110.262 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 188' ' ' ALA . . . . . 0.433 ' HA ' HD13 ' A' ' 116' ' ' LEU . . . -150.0 176.16 11.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.076 0.465 . . . . 74.43 111.495 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.76 135.17 36.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.795 -0.639 . . . . 64.33 109.594 178.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.634 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.2 pt? -140.12 140.02 35.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.2 0.524 . . . . 73.4 112.361 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.682 ' HB3' HG23 ' A' ' 215' ' ' THR . 0.0 OUTLIER -116.3 112.05 20.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.54 -0.754 . . . . 61.44 109.912 178.954 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.53 HD11 ' CZ ' ' A' ' 216' ' ' PHE . 2.1 mp -97.47 143.08 13.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.001 0.429 . . . . 70.2 111.543 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -76.89 154.88 83.11 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.861 -0.609 . . . . 62.34 110.676 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 194' ' ' PRO . . . . . 0.452 ' CG ' ' HA ' ' A' ' 211' ' ' ASN . 73.4 Cg_exo -50.89 -39.84 58.36 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.629 2.219 . . . . 74.31 112.419 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.31 -40.63 82.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 73.42 111.235 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.442 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 5.7 m0 -96.64 36.84 1.33 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.396 -0.365 . . . . 73.51 111.147 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -162.83 -76.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 75.52 110.888 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 198' ' ' TYR . . . . . 0.656 ' CD2' HD11 ' A' ' 214' ' ' LEU . 25.7 m-85 -106.27 -71.21 0.76 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 73.32 110.672 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 143.05 -179.9 20.25 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.799 -0.715 . . . . 55.4 112.673 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -59.34 -33.06 70.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.846 0.355 . . . . 53.32 110.903 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -51.73 48.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 64.51 110.783 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 113.51 -138.82 15.23 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.868 -0.682 . . . . 73.43 112.474 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.649 ' CB ' HD12 ' A' ' 208' ' ' ILE . 0.4 OUTLIER -153.99 79.62 5.12 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.862 0.363 . . . . 62.41 110.824 179.99 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.9 -22.93 25.66 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.577 2.185 . . . . 63.55 112.41 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.8 -41.96 87.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.399 -0.364 . . . . 72.51 110.965 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.429 ' HB3' HG13 ' A' ' 208' ' ' ILE . . . -111.35 27.89 9.25 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.173 -0.467 . . . . 64.12 111.19 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 55.48 30.83 15.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.233 -0.44 . . . . 75.24 111.077 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.649 HD12 ' CB ' ' A' ' 203' ' ' GLN . 31.1 mt -82.14 112.66 37.57 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.431 . . . . 74.33 111.074 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -60.04 158.99 27.44 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.474 2.116 . . . . 73.01 112.303 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -55.71 145.44 71.2 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.618 2.212 . . . . 71.51 112.284 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 211' ' ' ASN . . . . . 0.452 ' HA ' ' CG ' ' A' ' 194' ' ' PRO . 3.2 m-80 45.0 40.93 4.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.15 -0.477 . . . . 62.11 111.358 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -83.24 112.27 19.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 73.13 111.796 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.2 mmmm -65.02 140.63 58.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.009 -0.542 . . . . 75.3 110.276 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.656 HD11 ' CD2' ' A' ' 198' ' ' TYR . 5.4 mt -117.89 109.78 16.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.949 0.405 . . . . 74.22 112.026 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.682 HG23 ' HB3' ' A' ' 191' ' ' GLU . 1.9 m -109.16 142.88 39.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.917 -0.583 . . . . 63.11 110.061 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.598 ' CE1' HD21 ' A' ' 190' ' ' LEU . 14.8 p90 -156.57 -179.27 8.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.118 0.485 . . . . 73.54 111.617 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -131.34 135.16 47.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.612 -0.722 . . . . 74.13 110.418 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.745 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.8 t -122.82 150.46 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.457 . . . . 71.52 111.915 -179.019 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.67 110.45 8.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.733 -0.667 . . . . 75.35 110.256 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.726 HD21 HG13 ' A' ' 223' ' ' ILE . 2.0 tt -69.84 128.55 36.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.39 -0.368 . . . . 54.01 111.02 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 24.6 t -108.51 -29.07 2.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.158 -0.474 . . . . 62.45 111.296 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 222' ' ' ASP . . . . . 0.407 ' N ' HD23 ' A' ' 220' ' ' LEU . 5.4 t70 -170.41 161.14 7.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.881 0.372 . . . . 72.13 111.006 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.726 HG13 HD21 ' A' ' 220' ' ' LEU . 41.7 mt -140.19 110.62 3.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.096 -0.502 . . . . 71.12 111.057 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 224' ' ' ASP . . . . . 0.524 ' HB2' HG23 ' A' ' 130' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 74.03 110.859 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mtt . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.797 0.332 . . . . 74.32 111.186 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.655 ' HB3' ' HA3' ' A' ' 142' ' ' GLY . . . -140.62 169.7 17.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 53.43 111.078 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -157.56 107.25 2.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 43.01 111.092 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 59.26 163.63 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 53.44 111.084 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 1.041 HG11 HG21 ' A' ' 136' ' ' THR . 50.3 t -123.9 123.27 26.21 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.233 -0.439 . . . . 63.45 111.157 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -81.59 138.84 10.97 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.738 2.292 . . . . 71.54 112.325 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.436 HE22 HD11 ' A' ' 149' ' ' ILE . 11.5 mm100 -81.14 148.84 29.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 70.42 111.052 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.565 ' NE ' HD13 ' A' ' 149' ' ' ILE . 0.0 OUTLIER -51.92 120.59 5.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 74.25 111.102 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -94.95 -10.96 29.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.065 -0.516 . . . . 72.34 111.403 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.612 ' CD1' HD11 ' A' ' 20' ' ' LEU . 3.8 m-90 -138.19 173.67 11.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.912 0.386 . . . . 74.1 110.863 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.433 ' O ' HD12 ' A' ' 15' ' ' LEU . 1.3 m -118.22 152.06 36.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.009 -0.541 . . . . 75.02 110.661 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.506 HG12 ' HD2' ' A' ' 16' ' ' ARG . 34.2 t -57.71 -33.34 44.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.369 -0.378 . . . . 74.41 110.685 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -77.37 -24.94 50.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.964 -0.562 . . . . 62.5 111.037 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.03 -57.65 3.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.832 0.348 . . . . 70.25 110.843 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.709 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.4 mt -51.1 -60.71 2.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.221 -0.445 . . . . 72.24 111.001 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.619 ' HG3' HG11 ' A' ' 60' ' ' VAL . 28.1 mtt180 -54.16 -24.14 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 75.24 111.114 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.12 177.86 0.31 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.307 -0.406 . . . . 70.15 111.045 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -110.31 16.72 21.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.935 -0.575 . . . . 72.21 111.167 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -104.39 -27.86 11.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.514 -0.312 . . . . 73.24 111.156 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.834 HD22 HD11 ' A' ' 25' ' ' ILE . 6.5 tt -86.84 132.16 42.97 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.394 -0.366 . . . . 75.31 111.015 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.636 ' N ' HD23 ' A' ' 20' ' ' LEU . 71.1 Cg_endo -74.48 124.97 9.28 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.52 2.147 . . . . 74.44 112.398 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.402 ' HB3' ' NZ ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -56.93 -26.33 59.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 74.42 111.188 -179.976 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 mmtp -54.65 -49.06 71.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.301 -0.409 . . . . 62.52 111.293 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.05 -33.17 74.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.127 -0.488 . . . . 72.13 111.19 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.834 HD11 HD22 ' A' ' 20' ' ' LEU . 30.1 mt -66.9 -36.53 77.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 62.23 111.223 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.692 HG12 HD21 ' A' ' 59' ' ' LEU . 15.8 mt -71.85 -50.16 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.229 -0.442 . . . . 62.02 111.105 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.509 ' HG3' HD11 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -57.35 -22.9 45.53 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.847 -0.615 . . . . 45.21 111.286 -179.856 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -74.46 -50.81 16.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.013 0.435 . . . . 71.44 110.809 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.75 HD21 ' HA ' ' A' ' 63' ' ' TYR . 4.5 mt -64.3 -39.17 93.37 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.87 -0.605 . . . . 73.24 110.957 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -71.18 -20.22 62.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.309 -0.405 . . . . 73.22 110.727 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.444 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 9.4 tp10 -79.58 -52.21 8.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.133 -0.485 . . . . 64.54 111.472 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.444 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 84.4 m-70 -111.18 16.48 21.0 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.876 0.325 . . . . 73.23 111.876 -179.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' A' ' 29' ' ' LEU . . . -123.05 91.08 0.44 Allowed Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.517 -0.849 . . . . 71.05 112.631 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.1 p -33.68 156.08 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.672 0.619 . . . . 55.21 112.672 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.467 ' HA ' HD12 ' A' ' 38' ' ' LEU . 1.8 p-10 -51.45 -55.91 16.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.673 -0.694 . . . . 63.35 111.443 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.2 t -47.83 -48.05 31.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.04 0.447 . . . . 53.34 110.702 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.493 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 15.9 t80 -55.05 -49.0 72.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.678 -0.692 . . . . 75.5 110.727 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.748 HD22 ' HB3' ' A' ' 43' ' ' LEU . 11.6 mt -62.54 -45.54 92.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 64.14 110.937 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.947 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -49.93 -31.89 13.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.295 -0.411 . . . . 62.31 111.309 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -71.35 -33.15 69.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 74.11 111.034 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.534 ' ND1' ' HB2' ' A' ' 62' ' ' ALA . 14.3 m-70 -110.03 13.32 23.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.348 -0.387 . . . . 75.02 111.502 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt 58.86 33.67 23.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.794 0.331 . . . . 65.1 111.004 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.748 ' HB3' HD22 ' A' ' 38' ' ' LEU . 17.8 mt -88.76 -20.1 25.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.28 -0.418 . . . . 73.03 111.107 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.947 HD11 ' HB2' ' A' ' 39' ' ' ALA . 84.1 mt -47.77 170.32 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.894 0.378 . . . . 51.15 111.175 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.45 -154.78 24.45 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.771 -0.728 . . . . 64.41 112.778 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.87 ' O ' HG23 ' A' ' 50' ' ' VAL . 40.5 m-20 -109.92 150.4 28.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.96 0.41 . . . . 72.44 111.078 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.509 HD11 ' HG3' ' A' ' 27' ' ' LYS . 3.2 mp -46.71 -39.6 4.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.972 -0.558 . . . . 75.24 111.434 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -60.21 -42.45 95.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.057 -0.52 . . . . 64.43 111.102 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -85.56 -26.62 26.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.077 -0.51 . . . . 52.43 111.216 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.87 HG23 ' O ' ' A' ' 46' ' ' ASN . 17.5 t -79.58 -25.83 12.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.405 . . . . 73.53 111.448 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.42 -27.74 68.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.388 -0.369 . . . . 52.5 111.127 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.9 ptpp? -95.18 -29.21 14.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 65.15 110.986 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -96.34 33.55 1.76 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.449 . . . . 63.12 111.13 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -163.68 125.79 2.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.366 -0.379 . . . . 75.42 111.123 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.22 174.64 11.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 73.44 110.633 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.593 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -57.68 -58.29 8.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.892 0.377 . . . . 73.14 110.521 179.945 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.56 -24.48 67.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.005 -0.543 . . . . 72.33 110.584 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.21 -42.57 99.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.15 -0.477 . . . . 64.22 110.375 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.692 HD21 HG12 ' A' ' 26' ' ' ILE . 15.3 mt -74.85 -29.99 61.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.714 -0.675 . . . . 75.32 111.059 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.709 HG22 ' HB3' ' A' ' 15' ' ' LEU . 12.4 t -80.4 -43.87 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.987 0.422 . . . . 73.11 110.824 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.7 m -58.86 -34.33 71.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.93 -0.577 . . . . 73.41 110.532 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.534 ' HB2' ' ND1' ' A' ' 41' ' ' HIS . . . -83.59 -21.77 32.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.997 -0.547 . . . . 62.21 110.952 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.75 ' HA ' HD21 ' A' ' 29' ' ' LEU . 26.8 t80 -82.29 -22.88 35.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 70.42 111.025 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.568 ' ND2' HG12 ' A' ' 60' ' ' VAL . 48.3 m-80 -85.82 -53.18 5.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 74.2 111.474 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.493 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.2 p-80 -62.76 -27.5 69.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.991 -0.549 . . . . 73.31 111.498 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.711 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.5 tt -50.67 -40.68 54.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.871 0.367 . . . . 62.45 111.091 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -79.05 -40.84 30.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.015 -0.539 . . . . 72.4 110.682 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.82 -38.58 91.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.978 -0.556 . . . . 73.41 111.012 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.9 p -87.35 -11.84 48.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.091 -0.504 . . . . 61.55 111.46 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.724 ' HD3' HG21 ' A' ' 144' ' ' VAL . 25.0 mtmt 55.07 32.26 17.9 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.737 0.303 . . . . 75.13 111.161 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 30.9 mtt-85 -91.53 47.22 1.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.32 -0.4 . . . . 71.05 111.023 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -68.28 171.84 6.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 71.53 110.855 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.5 tttp -73.23 153.06 40.8 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.28 -0.418 . . . . 74.42 110.928 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -90.65 -149.09 22.18 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.755 -0.736 . . . . 71.43 112.469 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 12.8 p -100.03 92.44 5.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.792 0.33 . . . . 73.22 110.885 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -110.29 -32.98 6.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.241 -0.436 . . . . 73.32 110.907 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.3 m -173.29 125.35 0.41 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 62.53 110.887 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 4.7 mt -127.86 140.1 50.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 64.01 111.048 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.4 m 62.01 116.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 53.34 110.947 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 34.9 mmtm -149.8 147.9 28.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 73.45 110.861 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 11.3 p -144.11 131.52 17.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 74.01 111.074 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.1 t -149.79 -57.42 0.19 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 73.25 110.909 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -101.33 147.0 26.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 71.41 110.916 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.662 ' O ' HG13 ' A' ' 85' ' ' VAL . 4.4 mm100 -68.55 162.99 24.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.222 -0.445 . . . . 73.3 110.977 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.662 HG13 ' O ' ' A' ' 84' ' ' GLN . 0.8 OUTLIER -163.84 145.59 2.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.916 -0.584 . . . . 75.1 111.117 -179.664 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -159.36 -56.9 0.06 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.444 . . . . 74.42 110.883 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.0 t30 60.94 97.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 74.31 110.917 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.485 HG22 ' N ' ' A' ' 89' ' ' LYS . 11.2 p -80.36 158.58 4.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 73.51 111.031 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.485 ' N ' HG22 ' A' ' 88' ' ' VAL . 8.0 tptt -174.33 -40.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 75.42 110.929 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.2 mt -151.23 30.75 0.61 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.101 -0.499 . . . . 74.35 110.935 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 14.1 m120 59.95 109.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.215 -0.448 . . . . 55.33 110.932 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.06 147.13 48.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 73.35 110.847 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -128.5 147.5 50.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 73.03 110.908 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -158.56 87.33 2.32 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 75.42 110.899 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.09 124.1 14.03 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.6 2.2 . . . . 63.44 112.317 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 20.8 mttt 60.8 168.3 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.182 -0.463 . . . . 72.04 110.884 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.57 -172.03 0.22 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 54.13 110.926 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.6 t -102.23 155.57 18.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 75.3 110.918 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 2.0 tttp 60.35 31.64 20.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 74.3 110.916 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 16.7 m -136.59 120.32 17.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 74.41 110.896 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -100.95 99.2 9.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 65.53 110.899 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -138.08 31.17 2.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 71.23 110.899 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 5.0 t -131.38 -46.06 0.99 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 64.03 110.925 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 59.63 109.26 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.031 -0.532 . . . . 60.42 110.928 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -104.25 -53.26 2.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 54.44 110.935 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -179.87 -38.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.929 -0.578 . . . . 73.02 110.929 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 158.81 92.21 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.775 -0.726 . . . . 70.31 112.453 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.14 165.73 29.25 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.594 2.196 . . . . 65.42 112.334 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.405 ' HB3' ' CH2' ' A' ' 196' ' ' TRP . 63.3 Cg_exo -51.52 179.09 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.633 2.222 . . . . 54.41 112.307 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.461 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.4 OUTLIER -108.43 23.97 13.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 75.0 111.123 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.448 ' CZ ' ' HB2' ' A' ' 177' ' ' GLU . 4.1 p90 -132.73 -176.56 4.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 73.52 110.622 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.48 105.59 1.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.796 0.332 . . . . 75.33 111.06 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.483 ' CG ' HD22 ' A' ' 190' ' ' LEU . 0.0 OUTLIER -101.66 139.92 36.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 75.22 110.808 179.837 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.436 ' O ' ' HB1' ' A' ' 188' ' ' ALA . 0.4 OUTLIER -132.34 122.72 25.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 63.23 110.905 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.608 ' O ' HG13 ' A' ' 115' ' ' VAL . 9.5 p -84.0 106.38 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.472 . . . . 54.04 111.067 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.575 HD22 ' N ' ' A' ' 116' ' ' LEU . 2.8 mm? -87.68 -43.33 12.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 73.02 110.788 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 11.8 ttpp -118.22 107.9 14.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 73.23 110.94 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.08 134.36 55.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.211 -0.45 . . . . 74.14 111.057 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -103.23 -106.03 3.02 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.716 -0.754 . . . . 71.32 112.329 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.79 -42.78 11.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.96 0.41 . . . . 71.03 110.703 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.09 33.9 3.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.952 -0.567 . . . . 74.13 110.836 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 61.2 m -156.32 -45.6 0.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 71.23 110.839 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 -83.22 91.88 7.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 63.03 110.972 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -103.71 141.79 23.24 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 71.03 110.821 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.69 125.55 19.44 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.493 2.128 . . . . 72.22 112.356 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -97.98 158.88 15.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.117 -0.492 . . . . 64.03 110.849 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.91 111.13 1.18 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.275 -0.42 . . . . 71.4 110.809 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 111.33 -36.66 4.09 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.755 -0.736 . . . . 61.14 112.338 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.606 ' O ' HG22 ' A' ' 166' ' ' VAL . 0.5 OUTLIER -71.1 130.93 42.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 63.12 110.677 179.854 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.536 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 5.9 m -73.86 179.71 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.98 0.419 . . . . 70.2 111.429 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.804 HG12 HG23 ' A' ' 223' ' ' ILE . 21.5 m -156.84 147.69 11.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.8 -0.636 . . . . 74.34 110.916 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.427 ' HB3' ' HB2' ' A' ' 161' ' ' PRO . 0.7 OUTLIER -124.94 117.7 24.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.553 -0.294 . . . . 63.1 110.38 179.496 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.5 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.1 p -153.73 166.88 31.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.999 0.428 . . . . 55.43 111.509 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.624 ' O ' HG13 ' A' ' 218' ' ' VAL . 54.9 m95 -100.44 163.73 12.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.796 -0.638 . . . . 73.21 110.159 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.453 ' CD1' ' HB2' ' A' ' 148' ' ' ASN . 27.9 p90 -159.2 135.19 8.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.888 0.375 . . . . 64.23 111.593 -179.658 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' THR . . . . . 1.041 HG21 HG11 ' A' ' 5' ' ' VAL . 3.4 m -122.47 106.39 10.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.088 -0.505 . . . . 63.41 110.941 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.738 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -85.98 135.79 13.67 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.938 -0.649 . . . . 70.12 113.32 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.868 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -147.43 143.19 27.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.802 0.334 . . . . 73.53 110.617 179.599 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 139' ' ' LEU . 32.3 mt -81.95 -177.47 6.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 64.44 110.871 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -56.76 -42.86 80.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.469 . . . . 44.11 110.902 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.61 -9.07 58.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.949 -0.569 . . . . 72.3 111.31 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' GLY . . . . . 0.655 ' HA3' ' HB3' ' A' ' 2' ' ' ALA . . . 93.33 25.86 17.63 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.64 -0.79 . . . . 72.12 112.569 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 30.4 m -87.32 108.59 19.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.808 0.337 . . . . 61.1 110.87 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.724 HG21 ' HD3' ' A' ' 70' ' ' LYS . 21.2 t -63.72 127.46 24.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 51.54 111.089 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.428 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 52.1 p90 -110.13 -31.09 7.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.272 -0.422 . . . . 72.2 110.919 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -167.88 112.19 0.66 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 74.52 110.87 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.65 ' OG1' HG23 ' A' ' 136' ' ' THR . 11.9 t -125.07 126.9 46.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.211 -0.45 . . . . 53.01 110.965 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.453 ' HB2' ' CD1' ' A' ' 135' ' ' TYR . 8.8 t30 -65.58 -21.81 66.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.126 -0.488 . . . . 74.33 111.159 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.565 HD13 ' NE ' ' A' ' 8' ' ' ARG . 21.4 mt -106.15 119.72 55.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.393 -0.367 . . . . 61.23 111.417 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.9 -43.96 0.43 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.221 -0.445 . . . . 62.35 111.105 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 74.6 p -98.75 153.63 18.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.376 -0.374 . . . . 55.42 110.863 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 5.8 t -115.05 166.83 11.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 74.15 110.897 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -72.8 -29.65 63.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 33.41 111.156 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.95 -61.67 2.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.218 -0.447 . . . . 65.45 110.932 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.98 -63.08 1.42 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.924 -0.58 . . . . 65.32 110.917 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.4 tptt -150.66 119.65 6.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.888 -0.596 . . . . 73.44 110.874 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -65.26 80.22 0.05 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 65.42 110.893 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 24.7 m-20 -143.26 83.03 1.77 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 62.21 110.927 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.465 ' HB1' ' CH2' ' A' ' 134' ' ' TRP . . . -157.2 122.73 4.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 52.34 111.052 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 7.4 mtpt -131.13 119.36 17.74 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 72.1 110.881 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.427 ' HB2' ' HB3' ' A' ' 132' ' ' HIS . 54.0 Cg_exo -52.44 151.16 18.83 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.418 2.079 . . . . 74.14 112.26 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 2.5 tt -79.12 127.78 32.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 74.24 110.706 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.607 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 1.1 p -109.02 127.42 54.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.919 0.39 . . . . 63.14 111.346 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.772 ' CZ ' HD12 ' A' ' 179' ' ' LEU . 15.6 p90 -153.13 145.27 23.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.965 -0.562 . . . . 75.45 110.713 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.643 ' O ' HG22 ' A' ' 168' ' ' VAL . 15.8 mtmt -71.8 134.34 46.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.959 0.409 . . . . 74.31 111.028 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.606 HG22 ' O ' ' A' ' 129' ' ' ASP . 27.0 m -87.93 149.17 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.94 -0.573 . . . . 74.34 111.345 -179.641 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 62.43 29.24 72.78 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.827 -0.701 . . . . 73.51 112.607 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.643 HG22 ' O ' ' A' ' 165' ' ' LYS . 35.4 m -116.76 -33.01 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.927 0.394 . . . . 63.3 111.578 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 111.99 31.29 2.72 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.69 -0.767 . . . . 61.23 111.443 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -88.59 -29.71 19.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.759 0.314 . . . . 70.41 111.067 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 14.8 m -121.75 179.63 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 75.25 111.245 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.502 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 2.7 pt -59.58 169.45 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.108 -0.496 . . . . 63.22 111.082 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -76.05 -28.41 57.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.315 -0.402 . . . . 72.0 111.099 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -73.15 -30.57 62.76 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.72 -0.752 . . . . 74.55 112.015 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.794 ' HE1' HG21 ' A' ' 218' ' ' VAL . 0.6 OUTLIER -84.05 -34.46 24.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.88 0.372 . . . . 74.12 110.838 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -58.31 -40.76 82.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.036 -0.529 . . . . 73.11 110.488 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 177' ' ' GLU . . . . . 0.448 ' HB2' ' CZ ' ' A' ' 111' ' ' TYR . 4.8 mt-10 -80.14 -29.4 38.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.847 -0.615 . . . . 74.41 110.631 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.483 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -76.07 -60.77 2.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.205 -0.452 . . . . 64.31 111.23 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.772 HD12 ' CZ ' ' A' ' 164' ' ' PHE . 0.3 OUTLIER -56.3 -35.04 67.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.975 -0.557 . . . . 73.32 110.992 -179.95 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.5 tp -64.76 -28.4 69.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 63.43 111.06 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 22.4 m -89.5 -8.81 52.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.3 -0.409 . . . . 63.53 111.444 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -77.6 156.29 30.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.819 0.342 . . . . 75.31 110.963 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.81 168.96 9.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 73.23 110.875 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 184' ' ' LYS . . . . . 0.605 ' HA ' HD11 ' A' ' 223' ' ' ILE . 16.6 tttp -68.36 125.31 26.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.272 -0.422 . . . . 71.54 110.99 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 70.28 35.34 69.71 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.834 -0.698 . . . . 72.24 112.597 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -120.37 147.24 45.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.831 0.348 . . . . 75.22 110.922 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt -114.82 140.49 48.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 72.1 110.117 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 188' ' ' ALA . . . . . 0.436 ' HB1' ' O ' ' A' ' 114' ' ' SER . . . -147.58 175.86 10.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.028 0.442 . . . . 75.04 111.705 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 189' ' ' ARG . . . . . 0.469 ' C ' HD23 ' A' ' 190' ' ' LEU . 0.0 OUTLIER -128.23 120.05 26.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.777 -0.647 . . . . 72.13 109.981 179.568 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.857 ' O ' HG23 ' A' ' 215' ' ' THR . 3.5 mt -99.4 161.66 13.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.429 0.633 . . . . 71.42 112.271 -179.042 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -149.13 105.11 3.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.843 -1.071 . . . . 63.14 109.696 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.547 HG21 ' O ' ' A' ' 196' ' ' TRP . 3.0 mt -111.7 138.12 41.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.065 0.459 . . . . 75.45 111.798 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.423 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.3 mt-10 -75.84 167.83 33.22 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.647 -0.706 . . . . 54.44 110.445 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 194' ' ' PRO . . . . . 0.423 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 36.3 Cg_endo -64.8 -15.56 50.91 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.46 2.107 . . . . 74.33 112.633 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.14 -24.78 30.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.567 -0.288 . . . . 72.34 111.701 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.547 ' O ' HG21 ' A' ' 192' ' ' ILE . 3.0 m0 -110.37 37.18 2.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.74 0.305 . . . . 74.41 111.558 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 197' ' ' ALA . . . . . 0.487 ' HB1' HD12 ' A' ' 214' ' ' LEU . . . -149.78 -83.07 0.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.428 -0.351 . . . . 72.34 111.43 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 198' ' ' TYR . . . . . 0.647 ' CE2' HD13 ' A' ' 208' ' ' ILE . 25.5 m-85 -107.72 -31.65 7.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.98 0.419 . . . . 73.02 110.921 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 119.61 169.18 14.13 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.875 -0.679 . . . . 61.4 112.629 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.01 -29.75 44.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.885 0.374 . . . . 73.22 110.834 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -67.34 -46.88 72.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.081 -0.509 . . . . 73.52 110.68 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.56 -141.81 16.74 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.819 -0.705 . . . . 74.33 112.396 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.647 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.0 OUTLIER -155.77 79.41 4.25 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 120.846 0.355 . . . . 64.42 110.773 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.16 -22.68 26.53 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.65 2.233 . . . . 74.13 112.567 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.01 -42.05 84.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.898 0.38 . . . . 62.22 110.992 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.73 31.2 6.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.116 -0.493 . . . . 70.03 111.11 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 18.1 mtpt 56.86 32.95 22.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.246 -0.434 . . . . 75.55 110.935 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.647 HD12 ' HB3' ' A' ' 203' ' ' GLN . 50.4 mt -93.26 111.8 53.55 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.143 -0.481 . . . . 74.22 111.046 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -69.16 170.67 15.32 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.426 2.084 . . . . 61.02 112.384 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.23 151.47 49.04 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.63 2.22 . . . . 73.4 112.461 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 211' ' ' ASN . . . . . 0.401 ' HA ' ' CG ' ' A' ' 194' ' ' PRO . 24.2 m-80 57.15 24.86 10.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 71.11 111.329 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -83.75 147.22 27.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.894 0.378 . . . . 74.43 111.467 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 213' ' ' LYS . . . . . 0.728 ' O ' HD23 ' A' ' 214' ' ' LEU . 1.0 OUTLIER -93.92 156.09 16.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 72.14 110.303 179.519 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.728 HD23 ' O ' ' A' ' 213' ' ' LYS . 14.1 mt -136.4 109.51 7.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.953 0.406 . . . . 52.13 111.857 -179.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.857 HG23 ' O ' ' A' ' 190' ' ' LEU . 94.9 m -111.27 141.19 45.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.933 -0.576 . . . . 74.53 110.251 179.504 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.738 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 21.4 p90 -161.78 120.12 2.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.951 0.405 . . . . 74.52 111.73 -179.647 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.68 139.45 47.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.022 -0.535 . . . . 75.32 110.813 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.794 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.6 t -123.02 151.32 27.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.997 -0.547 . . . . 60.31 111.102 -179.429 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -136.8 111.32 8.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.281 -0.418 . . . . 64.24 110.639 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.735 HD13 HD11 ' A' ' 223' ' ' ILE . 0.4 OUTLIER -69.56 129.54 39.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.842 0.353 . . . . 71.13 110.835 -179.722 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 40.1 t -107.37 -30.54 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.475 . . . . 74.44 111.07 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -167.74 157.8 10.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.211 -0.45 . . . . 62.24 110.895 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.804 HG23 HG12 ' A' ' 131' ' ' VAL . 3.9 mp -141.14 111.31 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 74.11 111.091 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 34.5 t70 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 62.21 110.935 -179.961 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.4 mtt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.784 0.326 . . . . 73.54 111.191 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.22 142.42 28.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 71.22 111.102 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.788 ' HB2' ' O ' ' A' ' 139' ' ' LEU . . . 61.88 152.19 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.447 . . . . 62.01 111.009 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.562 ' HB2' ' O ' ' A' ' 3' ' ' ALA . . . 168.33 76.52 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.153 -0.476 . . . . 75.23 111.144 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.702 HG23 ' OG1' ' A' ' 138' ' ' THR . 42.4 t -83.68 112.48 40.22 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.507 -0.315 . . . . 72.22 110.798 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.454 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.3 Cg_endo -78.48 134.67 12.64 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.654 2.236 . . . . 74.21 112.525 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -80.19 156.54 26.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.178 -0.464 . . . . 61.13 110.807 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.25 93.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 60.24 111.379 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.44 86.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 73.33 110.992 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.573 ' CD1' HD11 ' A' ' 20' ' ' LEU . 1.5 m-90 -115.46 173.64 6.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.966 -0.561 . . . . 73.53 110.689 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.482 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -118.2 154.77 31.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.101 -0.5 . . . . 73.51 110.618 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.513 HG21 ' HG2' ' A' ' 154' ' ' LYS . 95.9 t -57.11 -35.87 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.973 0.416 . . . . 64.31 110.501 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -67.96 -30.34 69.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.87 -0.605 . . . . 41.44 111.143 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -82.04 -56.09 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.37 -0.377 . . . . 74.32 111.238 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.755 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.5 mt -49.55 -65.6 0.54 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.285 -0.416 . . . . 75.3 111.327 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.899 ' HD2' HG11 ' A' ' 60' ' ' VAL . 0.1 OUTLIER -53.71 -25.49 18.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 65.21 111.259 -179.898 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.42 173.68 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.99 0.424 . . . . 75.52 111.36 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.38 17.04 21.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.888 -0.596 . . . . 72.41 111.176 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -112.23 -19.98 12.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.655 0.264 . . . . 73.42 111.307 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.573 HD11 ' CD1' ' A' ' 10' ' ' TRP . 2.1 tt -90.59 112.18 51.68 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.609 -0.269 . . . . 74.54 111.008 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -57.69 128.42 29.1 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.411 2.074 . . . . 72.42 112.227 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.834 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -63.4 -24.15 67.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.462 . . . . 74.24 111.204 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.458 ' HA ' HD12 ' A' ' 26' ' ' ILE . 3.6 tptt -51.76 -40.13 59.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.394 -0.366 . . . . 74.5 111.581 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.89 -57.42 4.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.957 0.408 . . . . 70.43 111.164 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.834 HD12 ' HA ' ' A' ' 22' ' ' LYS . 4.7 mt -44.81 -32.78 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.891 -0.595 . . . . 75.44 111.556 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.673 HG12 HD21 ' A' ' 59' ' ' LEU . 7.4 mt -75.1 -40.7 44.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.937 0.399 . . . . 74.11 110.991 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -71.02 -24.03 62.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.977 -0.556 . . . . 63.33 111.029 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 24.1 t80 -71.47 -45.05 63.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.041 0.448 . . . . 53.41 110.86 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.854 HD13 HD13 ' A' ' 43' ' ' LEU . 6.1 mt -69.57 -24.01 63.64 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.783 -0.644 . . . . 74.52 111.11 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -79.3 -25.05 42.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.348 -0.387 . . . . 74.4 111.005 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.1 -10.58 18.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.384 -0.371 . . . . 72.33 111.24 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 11.9 m170 -117.62 -9.7 10.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.54 -0.3 . . . . 75.52 111.438 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.49 164.4 15.53 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.688 -0.768 . . . . 64.21 112.379 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.98 150.4 21.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.683 0.277 . . . . 61.51 110.555 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.681 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.5 OUTLIER -48.55 -57.01 6.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.833 0.349 . . . . 45.54 111.02 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.92 -49.57 39.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.054 0.454 . . . . 51.22 110.625 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.55 ' CE2' HD12 ' A' ' 66' ' ' LEU . 14.8 t80 -54.61 -48.02 72.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.707 -0.678 . . . . 63.24 110.431 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.419 HD21 ' O ' ' A' ' 29' ' ' LEU . 14.6 mt -63.98 -42.02 97.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.933 -0.576 . . . . 75.32 110.837 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.824 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -46.68 -40.29 12.96 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.187 -0.46 . . . . 71.12 111.05 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.56 -50.13 33.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.806 -0.634 . . . . 73.24 111.09 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -102.46 14.04 32.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.088 -0.505 . . . . 74.25 111.293 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.2 mttt 57.47 42.0 25.21 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.842 0.353 . . . . 74.55 110.959 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.854 HD13 HD13 ' A' ' 29' ' ' LEU . 19.8 mt -92.25 -22.43 19.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 71.14 111.463 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.824 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -77.6 156.8 30.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.026 0.441 . . . . 72.14 111.23 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.31 -122.27 5.39 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.646 -0.707 . . . . 73.33 112.489 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.846 ' O ' HG23 ' A' ' 50' ' ' VAL . 4.8 m120 -116.3 117.76 30.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.814 0.34 . . . . 74.44 110.964 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.665 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.97 -54.96 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.186 -0.461 . . . . 73.24 111.414 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.2 -37.81 16.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.9 -0.591 . . . . 45.33 111.075 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -85.77 -25.58 26.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.009 -0.541 . . . . 70.33 111.13 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.846 HG23 ' O ' ' A' ' 46' ' ' ASN . 25.1 t -82.35 -25.82 8.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 75.41 111.423 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.21 -15.78 63.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.815 0.341 . . . . 71.14 111.189 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.12 -32.36 13.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 75.55 110.914 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.0 m -88.82 -33.6 17.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.326 -0.397 . . . . 73.53 111.053 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -91.96 125.34 36.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 71.03 111.191 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -82.09 175.83 10.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 73.11 110.602 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.532 ' O ' HG23 ' A' ' 60' ' ' VAL . 6.9 tptt -58.42 -58.18 9.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.857 0.36 . . . . 73.54 110.587 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.0 -26.67 68.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.083 -0.508 . . . . 65.4 110.503 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -42.85 99.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.128 -0.487 . . . . 72.21 110.376 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.673 HD21 HG12 ' A' ' 26' ' ' ILE . 19.3 mt -71.6 -32.75 68.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.69 -0.686 . . . . 74.31 110.928 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.899 HG11 ' HD2' ' A' ' 16' ' ' ARG . 13.0 t -78.43 -42.29 26.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 52.24 110.94 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.3 m -59.41 -36.94 76.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.964 -0.562 . . . . 74.35 110.64 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.465 ' HB3' HD11 ' A' ' 43' ' ' LEU . . . -80.75 -22.17 40.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.019 -0.537 . . . . 75.11 110.999 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.647 ' HA ' HD21 ' A' ' 29' ' ' LEU . 21.6 t80 -83.78 -22.85 31.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 71.42 111.026 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -83.09 -54.73 4.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.279 -0.419 . . . . 74.35 111.545 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.501 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 4.2 p-80 -61.7 -29.13 69.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.098 -0.501 . . . . 71.0 111.366 -179.43 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.603 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.0 tt -51.98 -39.27 59.09 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.901 0.381 . . . . 74.24 111.118 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -78.81 -36.53 42.54 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.068 -0.514 . . . . 70.52 110.608 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.97 -39.87 83.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.961 -0.563 . . . . 61.53 110.745 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.68 -3.52 52.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.978 -0.556 . . . . 72.02 111.359 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.641 ' HE2' HG21 ' A' ' 136' ' ' THR . 8.3 mmtp 48.5 38.97 11.99 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.752 0.31 . . . . 75.41 111.316 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -93.85 43.5 1.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.379 . . . . 64.05 111.111 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.552 ' HA ' HD21 ' A' ' 66' ' ' LEU . 86.4 m-85 -66.3 179.61 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.434 . . . . 74.34 110.889 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.9 tttt -75.15 153.01 38.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 72.41 110.893 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -120.87 -86.31 0.9 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.775 -0.726 . . . . 50.33 112.436 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -157.23 110.43 2.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.824 0.345 . . . . 63.14 110.944 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -141.57 148.64 39.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 72.32 110.896 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.533 ' O ' HG23 ' A' ' 78' ' ' ILE . 1.4 t 60.28 73.32 0.49 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.129 -0.487 . . . . 62.54 110.939 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.533 HG23 ' O ' ' A' ' 77' ' ' SER . 7.1 pt -158.76 158.34 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.491 . . . . 73.52 111.144 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.65 89.11 5.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 75.44 110.875 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -81.26 146.46 30.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.182 -0.463 . . . . 74.44 110.891 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.2 m -112.41 144.69 19.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.146 -0.479 . . . . 52.33 111.111 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.9 t -114.03 -66.37 1.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.183 -0.462 . . . . 73.54 110.923 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -70.21 132.61 46.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 72.34 110.857 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -108.1 -31.47 7.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 62.04 110.902 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.7 p -115.67 147.0 19.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 72.33 111.075 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -106.57 -177.07 3.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 64.13 110.906 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -60.38 -179.77 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 63.03 110.868 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.5 t 63.5 109.08 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 53.43 111.138 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.9 tttp -70.04 84.99 0.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 71.43 110.884 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.1 tp -145.44 137.02 25.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 74.25 110.897 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -83.25 124.49 30.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 71.32 110.902 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -102.59 160.19 14.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.454 . . . . 74.44 110.927 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -127.06 138.48 53.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 71.24 110.872 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 28.5 mttm 60.22 85.41 0.18 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 75.24 110.872 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.87 147.02 61.25 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.54 2.16 . . . . 63.4 112.302 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -136.91 128.09 27.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 73.23 110.872 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -133.03 -76.68 0.49 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.467 . . . . 73.5 110.879 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 3.1 t -175.0 -40.38 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.966 -0.561 . . . . 72.24 110.878 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 2.7 tmtp? -92.76 110.18 21.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.105 -0.498 . . . . 74.1 110.906 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.6 p -138.42 152.6 48.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 72.11 110.895 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -160.28 35.5 0.17 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 54.4 110.929 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -81.03 138.5 36.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 74.42 110.927 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 58.2 p -140.73 147.92 39.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.434 . . . . 61.13 110.905 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.458 ' HA ' HD22 ' A' ' 104' ' ' LEU . 0.2 OUTLIER -103.01 -36.93 8.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 73.03 110.905 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 59.31 -174.28 0.1 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.078 -0.51 . . . . 72.34 110.948 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -97.38 -32.98 11.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 62.41 110.873 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 164.43 62.31 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.725 -0.75 . . . . 73.12 112.468 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.9 168.01 24.29 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.565 2.177 . . . . 62.13 112.279 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.96 -168.01 0.26 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.58 2.187 . . . . 61.25 112.319 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -104.65 36.8 2.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 74.43 110.819 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -165.66 163.95 19.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 70.12 110.807 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.413 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 33.3 m -128.33 129.0 45.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.469 . . . . 75.4 110.668 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.708 ' HD2' ' HB1' ' A' ' 178' ' ' ALA . 8.0 tttm -128.88 151.47 49.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.31 -0.405 . . . . 61.53 110.972 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.407 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.4 m -150.27 123.14 8.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 60.24 110.872 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 29.8 t -80.37 106.33 11.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 73.24 111.454 -179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.407 HD12 ' O ' ' A' ' 114' ' ' SER . 7.5 mp -76.46 -59.99 2.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.143 -0.48 . . . . 63.34 110.497 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -112.94 108.05 16.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.93 -0.577 . . . . 62.01 110.681 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.8 mtmp? -60.97 142.86 56.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 70.43 110.969 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.404 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -110.44 -159.04 16.72 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.773 -0.727 . . . . 65.32 112.211 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -35.03 -46.71 0.33 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.814 0.34 . . . . 63.1 111.654 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.626 ' O ' HG23 ' A' ' 122' ' ' THR . 0.5 OUTLIER 72.6 39.21 0.72 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 73.41 110.3 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.626 HG23 ' O ' ' A' ' 121' ' ' LYS . 0.8 OUTLIER -167.71 -42.68 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.686 -0.688 . . . . 71.41 110.423 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -84.71 86.4 7.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.018 -0.537 . . . . 75.13 110.669 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -106.0 155.54 38.23 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.044 -0.525 . . . . 64.34 110.822 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.6 ' HB2' HG21 ' A' ' 166' ' ' VAL . 56.0 Cg_endo -70.25 125.53 11.99 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.537 2.158 . . . . 50.54 112.469 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.25 155.66 17.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.095 -0.502 . . . . 74.25 110.867 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 1.1 tptm -56.92 119.23 5.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 75.51 110.945 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 94.44 -9.41 71.73 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.721 -0.752 . . . . 74.01 112.758 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.27 140.15 29.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.871 0.367 . . . . 62.53 110.995 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.69 HG12 ' O ' ' A' ' 224' ' ' ASP . 7.3 p -70.86 162.44 4.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.107 -0.497 . . . . 70.03 111.014 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.743 HG22 ' O ' ' A' ' 164' ' ' PHE . 4.4 m -153.59 144.98 14.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.137 -0.483 . . . . 64.54 111.009 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.451 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.87 117.84 22.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.738 0.304 . . . . 73.41 110.763 179.528 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.735 ' HB3' HD22 ' A' ' 220' ' ' LEU . 30.3 p -150.21 168.94 22.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.077 0.465 . . . . 54.44 111.102 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.838 ' HB3' HD11 ' A' ' 149' ' ' ILE . 80.6 m95 -102.64 157.52 16.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.729 -0.669 . . . . 64.14 110.015 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 53.2 p90 -162.23 138.73 7.86 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.148 0.499 . . . . 72.43 112.055 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.679 HG21 HG11 ' A' ' 5' ' ' VAL . 22.1 m -131.35 116.23 17.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.478 -0.783 . . . . 73.24 110.335 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.599 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -98.16 145.17 17.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.601 -0.809 . . . . 63.12 113.291 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.702 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.1 OUTLIER -147.9 143.24 27.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.832 0.349 . . . . 62.34 110.75 179.756 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.788 ' O ' ' HB2' ' A' ' 3' ' ' ALA . 90.7 mt -88.64 -179.53 6.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 73.33 110.756 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -52.88 -45.14 67.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.301 -0.409 . . . . 74.01 111.075 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.0 -13.22 62.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.974 -0.557 . . . . 74.01 111.326 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 88.27 25.85 29.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.651 -0.785 . . . . 64.45 112.59 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -98.27 124.88 43.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.815 0.341 . . . . 74.21 110.817 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.2 t -63.7 129.41 27.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 62.23 111.085 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.43 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 54.1 p90 -110.83 -33.65 6.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 73.24 111.012 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ASP . . . . . 0.41 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 13.9 m-20 -162.53 110.27 1.32 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 75.42 110.949 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 9.2 t -142.91 127.68 18.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 71.44 110.951 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 34.2 p-10 -92.71 52.58 1.89 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 73.23 110.385 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.838 HD11 ' HB3' ' A' ' 134' ' ' TRP . 27.9 mm -125.1 102.31 10.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.064 -0.516 . . . . 65.53 110.886 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -96.51 -75.69 0.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 74.11 110.943 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 69.4 p -146.37 165.99 27.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 54.44 110.93 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.12 -178.78 6.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.125 -0.489 . . . . 62.12 110.877 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -80.86 -29.06 35.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 53.35 111.142 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' LYS . . . . . 0.513 ' HG2' HG21 ' A' ' 12' ' ' VAL . 0.7 OUTLIER -58.67 -31.33 68.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.436 . . . . 71.12 110.989 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.12 -63.07 1.25 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 74.23 110.966 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 3.5 pttt -172.43 152.36 2.67 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.846 -0.615 . . . . 73.02 110.898 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 7.8 mmtp -66.18 78.26 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 65.24 110.894 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -153.37 43.15 0.59 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.479 . . . . 64.24 110.88 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.12 127.72 6.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 73.12 111.08 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.25 146.45 36.47 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 65.03 110.819 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.42 155.84 68.66 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.538 2.159 . . . . 72.33 112.234 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.417 ' O ' HD23 ' A' ' 162' ' ' LEU . 3.6 tt -75.44 121.44 22.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.31 -0.404 . . . . 73.32 110.576 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.621 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.67 122.29 42.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.946 0.403 . . . . 73.13 111.305 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.743 ' O ' HG22 ' A' ' 131' ' ' VAL . 10.8 p90 -151.81 143.67 23.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.909 -0.587 . . . . 72.34 110.557 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.581 ' O ' HG22 ' A' ' 168' ' ' VAL . 4.6 mttp -80.96 138.71 36.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.079 0.466 . . . . 73.24 111.323 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.6 HG21 ' HB2' ' A' ' 125' ' ' PRO . 35.8 m -87.38 149.42 4.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.618 -0.719 . . . . 71.52 111.188 -179.388 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.77 21.71 78.86 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.805 -0.712 . . . . 53.23 112.637 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.745 HG23 ' HG2' ' A' ' 170' ' ' LYS . 29.3 m -130.16 41.15 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.871 0.367 . . . . 74.13 111.134 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.47 38.58 5.34 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 121.125 -0.56 . . . . 74.23 113.154 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 170' ' ' LYS . . . . . 0.745 ' HG2' HG23 ' A' ' 168' ' ' VAL . 0.4 OUTLIER -84.69 -41.86 15.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.865 0.364 . . . . 72.35 110.95 -179.945 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.7 m -121.95 179.78 2.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.112 -0.494 . . . . 54.24 110.994 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.539 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -59.88 159.48 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.331 -0.395 . . . . 75.44 111.158 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -67.72 -28.26 67.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.204 -0.453 . . . . 72.03 111.139 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.5 -37.58 46.43 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.668 -0.777 . . . . 61.32 111.958 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.714 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.3 t90 -78.33 -33.48 49.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.919 0.39 . . . . 62.43 110.998 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 176' ' ' ASP . . . . . 0.697 ' O ' HD13 ' A' ' 180' ' ' LEU . 38.9 t70 -64.31 -33.87 76.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.967 -0.561 . . . . 75.33 110.444 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -78.65 -29.71 45.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 71.4 110.662 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.708 ' HB1' ' HD2' ' A' ' 113' ' ' LYS . . . -81.16 -45.47 16.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 50.21 111.105 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.62 HD21 ' NE1' ' A' ' 175' ' ' TRP . 11.8 mt -72.39 -18.92 61.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.016 -0.538 . . . . 74.25 111.167 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.697 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.3 tp -56.38 -24.18 42.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.429 -0.351 . . . . 72.54 111.345 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 16.2 p -114.5 18.09 16.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.627 -0.26 . . . . 75.3 111.618 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 3.5 mmm -68.13 103.48 1.56 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.869 0.366 . . . . 73.02 110.913 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.22 148.99 49.06 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.195 -0.457 . . . . 75.13 110.839 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 3.2 ttmt -54.85 115.77 2.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.506 . . . . 70.31 111.216 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 77.39 20.05 75.48 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.921 -0.656 . . . . 60.02 113.201 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 186' ' ' GLU . . . . . 0.404 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.6 tt0 -93.69 146.48 23.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.867 0.333 . . . . 73.3 111.032 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -119.22 136.23 54.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 73.24 109.936 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -150.57 176.25 11.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.106 0.479 . . . . 63.34 111.831 -179.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.88 133.52 33.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.604 -0.726 . . . . 73.22 109.477 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.701 HD11 ' CD1' ' A' ' 175' ' ' TRP . 1.6 pt? -140.07 141.53 36.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.135 0.493 . . . . 74.45 112.109 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.828 ' HG3' HG23 ' A' ' 215' ' ' THR . 2.5 mp0 -116.94 112.39 20.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.549 -0.75 . . . . 64.22 110.021 179.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.58 HD11 HD12 ' A' ' 190' ' ' LEU . 1.3 mm -92.18 150.26 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.922 0.391 . . . . 73.35 111.214 -179.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -83.37 166.4 35.04 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.525 . . . . 72.53 110.69 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 194' ' ' PRO . . . . . 0.402 ' CB ' ' HA ' ' A' ' 211' ' ' ASN . 40.1 Cg_endo -66.91 -14.76 44.95 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.532 2.155 . . . . 73.1 112.6 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -84.23 -31.18 25.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 62.13 111.034 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.435 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 14.4 m0 -107.54 37.03 2.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.416 . . . . 74.02 111.075 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -154.44 -81.06 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 64.41 111.087 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 198' ' ' TYR . . . . . 0.582 ' CE2' HD11 ' A' ' 214' ' ' LEU . 41.7 m-85 -106.11 -71.31 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.033 0.444 . . . . 74.13 110.762 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 151.34 176.56 24.28 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.721 -0.752 . . . . 43.32 112.597 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.31 -30.01 36.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.857 0.36 . . . . 74.42 110.798 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -49.73 19.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 70.31 110.686 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 107.35 -128.22 9.13 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.836 -0.697 . . . . 53.02 112.536 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.732 ' CB ' HD12 ' A' ' 208' ' ' ILE . 0.0 OUTLIER -156.69 82.34 3.34 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.871 0.367 . . . . 71.43 110.753 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.57 -24.57 29.51 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.634 2.223 . . . . 71.3 112.481 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.42 -42.02 96.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.845 0.355 . . . . 75.41 111.027 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -103.53 28.83 6.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 70.25 111.257 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.43 29.8 15.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.268 -0.424 . . . . 73.43 111.023 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.778 HG12 HD11 ' A' ' 139' ' ' LEU . 40.2 mt -90.49 111.68 48.77 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.219 -0.446 . . . . 71.23 111.07 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.21 170.89 19.14 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.527 2.151 . . . . 73.11 112.429 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.7 142.15 96.99 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.641 2.228 . . . . 71.13 112.177 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 211' ' ' ASN . . . . . 0.402 ' HA ' ' CB ' ' A' ' 194' ' ' PRO . 57.5 m-80 47.82 76.67 0.11 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.356 -0.384 . . . . 70.2 111.116 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.08 113.56 17.91 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.357 -0.383 . . . . 70.12 111.581 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.57 126.84 29.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.134 -0.485 . . . . 41.33 110.253 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.582 HD11 ' CE2' ' A' ' 198' ' ' TYR . 13.0 mt -103.35 109.45 21.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.851 0.358 . . . . 72.13 111.556 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.828 HG23 ' HG3' ' A' ' 191' ' ' GLU . 20.5 m -103.26 136.85 42.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 62.4 110.617 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.627 ' CE1' HD21 ' A' ' 190' ' ' LEU . 29.3 p90 -155.38 176.3 12.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.061 0.458 . . . . 64.35 111.539 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -131.63 135.29 46.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.707 -0.679 . . . . 75.43 110.612 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.714 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.3 t -121.95 149.99 25.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.11 0.481 . . . . 73.41 111.924 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -136.91 110.46 8.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.737 -0.665 . . . . 72.4 110.453 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.735 HD22 ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.93 130.76 43.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.345 . . . . 70.22 110.897 -179.664 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.415 HG23 ' HA ' ' A' ' 133' ' ' CYS . 18.3 t -110.25 -30.13 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.221 -0.445 . . . . 52.25 111.633 -179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -168.86 158.61 8.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.865 0.364 . . . . 62.42 111.069 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.668 HG23 HG12 ' A' ' 131' ' ' VAL . 3.4 mp -142.12 112.12 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 63.32 111.097 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 224' ' ' ASP . . . . . 0.69 ' O ' HG12 ' A' ' 130' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-O 121.073 0.463 . . . . 73.15 110.826 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.7 mtt . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.851 0.357 . . . . 54.0 111.17 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.23 175.47 0.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 52.23 111.09 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -174.25 40.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 51.24 111.114 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -81.63 172.82 12.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 63.22 111.08 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 1.043 HG11 HG21 ' A' ' 136' ' ' THR . 33.2 t -60.04 110.81 3.14 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.139 -0.482 . . . . 64.44 111.044 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.423 ' HD2' ' CD2' ' A' ' 72' ' ' PHE . 92.4 Cg_endo -78.98 139.56 15.36 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.607 2.205 . . . . 71.4 112.428 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -80.62 151.87 28.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.168 -0.469 . . . . 51.22 110.827 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.82 92.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.2 -0.455 . . . . 73.54 111.299 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.89 -35.45 76.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 71.05 111.027 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 2.4 m-90 -114.62 173.68 6.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.087 -0.506 . . . . 72.33 110.866 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.449 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -118.25 154.33 32.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.081 -0.509 . . . . 72.32 110.644 179.774 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.51 HG12 ' HD2' ' A' ' 16' ' ' ARG . 43.7 t -55.13 -34.28 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.353 -0.385 . . . . 51.24 110.927 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -65.01 -32.38 74.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.108 -0.496 . . . . 72.51 110.839 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.449 ' HB2' HG23 ' A' ' 11' ' ' THR . 1.4 tp-100 -82.05 -56.1 4.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.346 -0.388 . . . . 73.24 110.835 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.82 ' HB3' HG22 ' A' ' 60' ' ' VAL . 8.3 mt -50.21 -28.75 8.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.202 -0.454 . . . . 64.32 110.82 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.51 ' HD2' HG12 ' A' ' 12' ' ' VAL . 60.6 mtt180 -94.63 -28.7 15.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.766 -0.652 . . . . 72.43 110.337 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.4 t -53.12 170.2 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.881 -0.6 . . . . 64.11 111.314 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -103.69 17.11 24.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.733 -0.667 . . . . 73.33 111.123 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -113.65 -20.66 11.12 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.489 -0.323 . . . . 72.2 111.357 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.649 HD23 ' N ' ' A' ' 21' ' ' PRO . 6.2 tt -84.78 129.48 56.61 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.591 -0.277 . . . . 73.43 110.959 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.649 ' N ' HD23 ' A' ' 20' ' ' LEU . 73.6 Cg_endo -77.23 125.64 7.97 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.5 2.133 . . . . 55.51 112.255 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -24.1 66.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 70.34 110.952 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.428 ' HA ' HD12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -54.26 -35.21 62.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.282 -0.417 . . . . 62.44 111.465 -179.751 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.26 -54.48 6.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.966 0.413 . . . . 64.25 111.046 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.673 ' O ' HD12 ' A' ' 29' ' ' LEU . 29.1 mt -45.0 -32.9 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 64.04 111.38 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.641 HG12 HD21 ' A' ' 59' ' ' LEU . 6.1 mt -76.51 -49.97 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 54.04 110.925 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.42 ' HE2' HD13 ' A' ' 47' ' ' ILE . 34.8 mttm -64.8 -25.57 67.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.812 -0.631 . . . . 72.44 111.115 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -70.4 -45.38 66.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.997 0.427 . . . . 75.24 110.834 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.764 HD21 ' HA ' ' A' ' 63' ' ' TYR . 3.4 mt -69.97 -36.48 75.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.851 -0.613 . . . . 65.53 110.946 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.495 ' HA ' HD11 ' A' ' 38' ' ' LEU . 6.7 mt-30 -69.59 -20.72 63.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.176 -0.465 . . . . 72.45 110.707 179.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.2 -51.06 5.35 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.148 -0.478 . . . . 72.34 110.963 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -88.87 0.91 56.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 71.52 111.612 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.38 160.45 14.33 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.673 -0.775 . . . . 64.24 112.445 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -92.55 151.87 19.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.547 0.213 . . . . 71.24 110.458 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.685 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -48.94 -57.12 6.98 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.81 0.338 . . . . 54.44 111.176 -179.745 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -47.78 -51.65 21.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.059 0.457 . . . . 61.22 110.842 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.508 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 10.8 t80 -52.76 -47.51 67.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.82 -0.627 . . . . 62.51 110.477 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.495 HD11 ' HA ' ' A' ' 30' ' ' GLN . 11.2 mt -66.32 -40.88 90.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.073 -0.512 . . . . 64.45 110.764 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.804 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.83 -47.51 31.3 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.056 0.455 . . . . 71.13 111.079 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -57.64 -26.91 62.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.765 -0.652 . . . . 74.03 110.895 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 43.9 m-70 -112.63 11.16 19.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.276 -0.42 . . . . 75.12 111.261 179.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt 51.15 35.47 13.3 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.858 0.361 . . . . 64.13 110.93 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.652 HD13 HD13 ' A' ' 29' ' ' LEU . 29.1 mt -94.18 -20.34 19.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.132 -0.485 . . . . 73.45 111.736 -179.405 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.804 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.69 158.76 26.89 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.046 0.45 . . . . 63.32 111.121 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 114.57 -119.37 4.67 Favored Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 115.798 -0.637 . . . . 75.24 112.404 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.747 ' O ' HG23 ' A' ' 50' ' ' VAL . 5.6 m120 -116.34 113.79 23.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.751 0.31 . . . . 70.13 110.9 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.617 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -45.58 -54.64 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.192 -0.458 . . . . 74.42 111.374 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.27 -36.55 9.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.87 -0.605 . . . . 71.42 110.92 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -85.64 -25.23 26.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.992 -0.549 . . . . 74.21 111.102 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.747 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.7 t -83.45 -25.81 7.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.297 -0.41 . . . . 70.34 111.479 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.0 -15.83 63.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.37 -0.377 . . . . 65.11 111.41 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -95.19 -34.02 12.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.818 0.342 . . . . 73.3 110.999 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.623 HG22 ' HA ' ' A' ' 50' ' ' VAL . 9.8 t -87.94 -30.56 19.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.46 . . . . 65.51 111.081 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.45 125.8 37.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.427 . . . . 73.32 111.132 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.09 174.84 10.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 71.25 110.642 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.627 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -57.77 -58.1 9.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.861 0.363 . . . . 62.43 110.505 179.932 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.59 -26.99 68.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.121 -0.491 . . . . 75.34 110.573 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.91 -43.4 98.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.095 -0.502 . . . . 70.44 110.475 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.641 HD21 HG12 ' A' ' 26' ' ' ILE . 20.4 mt -73.48 -32.64 64.41 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.713 -0.676 . . . . 73.41 110.973 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.82 HG22 ' HB3' ' A' ' 15' ' ' LEU . 15.9 t -76.9 -42.39 32.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.005 0.431 . . . . 74.11 110.695 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.0 m -60.73 -33.44 72.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.869 -0.605 . . . . 73.34 110.516 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.445 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -81.13 -22.25 39.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.483 . . . . 75.32 111.045 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.764 ' HA ' HD21 ' A' ' 29' ' ' LEU . 14.0 t80 -83.66 -22.9 32.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.099 -0.5 . . . . 73.11 111.126 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -83.95 -54.16 5.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.046 0.45 . . . . 71.22 111.294 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.585 ' HD2' HG21 ' A' ' 69' ' ' THR . 3.1 p-80 -60.78 -31.09 70.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.02 -0.536 . . . . 65.11 111.036 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.648 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.7 tt -46.1 -41.12 11.89 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.899 0.381 . . . . 63.2 111.162 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -78.13 -42.14 32.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.018 -0.537 . . . . 72.34 110.268 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -70.03 -13.07 62.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.853 -0.612 . . . . 70.05 110.933 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.585 HG21 ' HD2' ' A' ' 65' ' ' HIS . 35.8 p -108.72 -16.07 14.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.179 -0.464 . . . . 51.13 111.195 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.29 30.65 17.11 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.793 0.33 . . . . 72.12 110.942 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -96.1 44.27 1.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 74.44 111.047 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.423 ' CD2' ' HD2' ' A' ' 6' ' ' PRO . 75.5 m-85 -66.86 175.95 2.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 65.12 110.696 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.36 147.45 44.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 72.23 110.879 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 164.18 148.37 5.41 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.696 -0.764 . . . . 62.11 112.514 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.6 p 56.29 103.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.859 0.361 . . . . 64.34 111.007 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -176.94 -39.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 71.32 110.935 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.92 134.83 6.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.097 -0.501 . . . . 71.34 110.926 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 23.9 mt -112.56 151.81 14.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 75.53 111.102 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.5 m -72.56 126.52 30.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 42.42 110.911 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.85 148.97 29.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 71.33 110.903 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -85.6 129.07 38.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 52.22 111.135 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.7 m -103.09 144.17 31.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 42.42 110.924 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.56 148.7 27.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.155 -0.475 . . . . 74.25 110.883 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 60.46 110.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 61.34 110.925 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.7 t -108.19 145.48 15.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 74.11 111.068 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -74.26 -55.78 5.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 61.24 110.888 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.577 ' OD1' HD22 ' A' ' 90' ' ' LEU . 23.3 m-20 -87.92 141.62 28.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 71.4 110.887 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.3 m -107.73 108.41 25.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 61.52 111.136 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.64 34.6 20.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 75.31 110.929 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.577 HD22 ' OD1' ' A' ' 87' ' ' ASN . 1.1 tp -108.98 143.6 38.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 73.31 110.927 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 60.8 111.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 72.32 110.92 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -104.22 159.51 15.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 70.22 110.913 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -177.56 -39.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 75.34 110.94 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.3 tptt -162.55 79.93 1.8 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.083 -0.508 . . . . 74.22 110.877 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -52.23 121.47 8.97 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.587 2.191 . . . . 51.1 112.356 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 62.0 151.29 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 75.31 110.929 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -109.98 -32.12 7.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 71.32 110.873 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.0 t 43.43 69.37 0.41 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.159 -0.473 . . . . 72.33 111.474 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -84.13 118.74 24.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 73.15 110.908 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 83.6 p -151.0 -175.41 5.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 65.24 110.932 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -143.91 35.49 1.26 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.223 -0.444 . . . . 72.03 110.905 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -146.14 101.92 3.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 63.21 110.914 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 69.9 p -110.11 -32.88 6.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 74.31 110.937 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.4 mp -108.32 151.07 26.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 65.34 110.868 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -137.89 31.27 2.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 75.31 110.917 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -110.58 -32.32 6.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 64.1 110.918 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 136.44 69.99 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.727 -0.749 . . . . 74.42 112.502 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.77 154.59 67.52 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.591 2.194 . . . . 71.51 112.324 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.448 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 55.8 Cg_endo -70.16 -166.78 0.21 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.565 2.177 . . . . 74.1 112.284 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.439 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -97.66 30.61 2.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.274 -0.421 . . . . 72.54 110.987 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.448 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 31.7 p90 -152.36 171.5 17.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.307 -0.406 . . . . 73.1 110.88 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.415 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 0.2 OUTLIER -134.52 129.22 34.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 75.41 110.56 179.828 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.41 ' CG ' ' HB3' ' A' ' 190' ' ' LEU . 0.0 OUTLIER -120.32 151.54 39.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 62.41 111.056 -179.776 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.401 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.3 m -150.08 114.1 5.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.144 -0.48 . . . . 71.44 110.875 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.61 ' O ' HG13 ' A' ' 115' ' ' VAL . 9.7 p -80.7 106.6 12.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.249 -0.432 . . . . 75.35 111.134 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.401 HD12 ' O ' ' A' ' 114' ' ' SER . 6.4 mp -78.31 -77.11 0.17 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.476 . . . . 61.51 111.076 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -96.76 110.0 22.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.267 -0.424 . . . . 74.11 111.08 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.2 mtmt -59.43 139.6 56.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 64.32 110.804 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.514 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -111.68 -154.78 12.88 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.682 -0.77 . . . . 24.21 112.659 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -37.29 -52.92 1.09 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.049 0.452 . . . . 44.51 111.412 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 tmtp? 71.85 36.17 1.24 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.793 -0.64 . . . . 71.42 110.234 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -156.91 -44.61 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.791 -0.64 . . . . 73.35 110.775 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -87.59 97.08 10.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.117 -0.492 . . . . 72.53 110.919 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -109.41 154.82 42.04 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.089 -0.505 . . . . 75.13 110.642 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.69 ' HB2' HG21 ' A' ' 166' ' ' VAL . 58.5 Cg_endo -71.59 125.47 11.2 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.515 2.143 . . . . 65.33 112.439 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.1 tttm -92.99 160.22 14.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 75.22 110.899 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -57.89 119.47 6.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.286 -0.415 . . . . 72.14 110.947 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 87.45 1.8 83.21 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.745 -0.74 . . . . 75.11 112.833 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -92.13 139.41 30.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.878 0.37 . . . . 74.33 110.967 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.524 HG22 ' N ' ' A' ' 131' ' ' VAL . 4.4 p -71.66 162.04 4.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.066 -0.515 . . . . 75.03 110.909 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.699 HG12 HG23 ' A' ' 223' ' ' ILE . 9.3 m -154.56 145.58 13.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.042 -0.526 . . . . 52.02 110.987 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.452 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -128.35 117.95 22.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.728 0.299 . . . . 75.05 110.936 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.455 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 29.1 p -154.26 170.3 21.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.919 0.39 . . . . 33.5 111.196 -179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.61 ' HB3' HD11 ' A' ' 149' ' ' ILE . 66.3 m95 -104.19 161.01 14.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.938 -0.574 . . . . 74.52 110.149 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.506 ' OH ' HD13 ' A' ' 162' ' ' LEU . 4.5 p90 -159.5 134.98 8.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.03 0.443 . . . . 73.42 111.702 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' THR . . . . . 1.043 HG21 HG11 ' A' ' 5' ' ' VAL . 22.5 m -127.83 113.55 16.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 70.52 110.307 179.467 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.601 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.18 144.2 17.06 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.629 -0.796 . . . . 53.53 113.342 -179.272 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.84 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.44 130.77 13.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.756 0.312 . . . . 62.14 110.457 179.675 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.66 HD21 HG23 ' A' ' 208' ' ' ILE . 91.3 mt -66.02 -178.0 0.56 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.395 -0.366 . . . . 70.13 110.849 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -56.7 -42.3 78.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 75.33 110.76 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.46 -5.22 56.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.97 -0.559 . . . . 73.11 111.395 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 95.89 25.76 12.62 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.624 -0.798 . . . . 65.12 112.634 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' THR . . . . . 0.645 ' HB ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -80.89 113.02 18.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.876 0.37 . . . . 72.1 110.837 180.0 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.479 ' CG2' HG23 ' A' ' 147' ' ' THR . 11.3 p -71.6 121.42 21.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 73.42 111.136 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.442 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 53.3 p90 -113.28 -17.08 12.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 50.33 111.315 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.09 127.52 7.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.797 0.332 . . . . 73.42 110.951 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.874 HG22 HG23 ' A' ' 136' ' ' THR . 1.0 OUTLIER -142.87 98.01 3.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 73.22 111.005 -179.992 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -77.26 -9.16 58.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.224 -0.444 . . . . 73.52 111.075 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.693 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.5 mp -94.54 117.76 39.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.383 -0.371 . . . . 51.32 110.962 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -106.06 -73.38 0.68 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.455 . . . . 72.1 110.89 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 4.1 m -145.53 166.01 26.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 55.13 110.902 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 94.4 p -77.2 166.45 23.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 72.42 110.92 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.0 -31.01 34.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 73.43 111.123 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 13.0 mmmt -59.94 -31.49 69.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 65.04 110.969 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 2.5 tptp -88.67 -33.58 17.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.462 . . . . 75.31 110.895 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -176.83 148.57 0.68 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 72.24 110.855 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -88.63 89.63 8.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 73.41 110.923 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 58.8 m-20 -158.83 45.99 0.3 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 73.41 110.831 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.11 114.43 3.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 74.41 111.092 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -129.83 128.4 22.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 74.22 110.89 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.09 148.2 40.65 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.411 2.074 . . . . 74.2 112.314 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.506 HD13 ' OH ' ' A' ' 135' ' ' TYR . 0.3 OUTLIER -73.47 120.76 19.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 50.54 110.532 179.797 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.644 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -103.55 122.7 45.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.944 0.402 . . . . 64.34 111.336 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.655 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 25.2 p90 -153.74 145.58 23.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.002 -0.544 . . . . 74.44 110.637 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.452 ' HB3' HG21 ' A' ' 168' ' ' VAL . 60.9 mttt -80.75 138.49 36.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.128 0.489 . . . . 73.3 111.29 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.69 HG21 ' HB2' ' A' ' 125' ' ' PRO . 17.8 m -87.27 149.35 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.652 -0.704 . . . . 73.24 111.05 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.0 23.7 76.91 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.777 -0.725 . . . . 73.22 112.408 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.452 HG21 ' HB3' ' A' ' 165' ' ' LYS . 0.8 OUTLIER -132.55 39.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.939 0.4 . . . . 62.32 110.926 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 47.36 38.77 13.34 Favored Glycine 0 C--N 1.33 0.202 0 C-N-CA 121.02 -0.609 . . . . 61.22 112.85 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.5 -47.05 11.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.915 0.388 . . . . 72.4 110.872 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 171' ' ' VAL . . . . . 0.466 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.2 OUTLIER -120.08 -179.68 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.96 -0.564 . . . . 74.35 111.022 179.898 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.522 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 4.0 pt -59.64 161.02 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.32 -0.4 . . . . 73.22 111.285 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -69.07 -27.88 66.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 75.2 110.986 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.83 -37.75 38.29 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.673 -0.775 . . . . 62.3 112.03 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.695 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.7 t90 -78.44 -33.43 48.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.921 0.391 . . . . 74.44 111.09 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -69.05 -29.05 67.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.973 -0.558 . . . . 64.41 110.695 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -81.76 -28.72 33.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 75.42 110.827 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.568 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -85.27 -51.55 6.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.277 -0.42 . . . . 73.24 111.212 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.655 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 2.9 mt -54.39 -36.71 64.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.991 -0.55 . . . . 75.12 110.773 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 3.1 tp -54.15 -25.02 20.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 70.24 110.996 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.16 -0.0 57.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 60.11 111.445 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 23.2 mmm -80.54 150.14 29.7 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.867 0.365 . . . . 55.31 110.909 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.52 171.08 8.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.104 -0.498 . . . . 71.31 111.18 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 184' ' ' LYS . . . . . 0.511 ' HA ' HD22 ' A' ' 220' ' ' LEU . 3.6 tttt -62.7 117.1 5.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.037 -0.529 . . . . 63.13 110.68 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 185' ' ' GLY . . . . . 0.401 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 69.07 65.63 2.54 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.617 -0.802 . . . . 72.41 112.398 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 186' ' ' GLU . . . . . 0.514 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.5 tt0 -145.05 145.14 31.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.663 0.268 . . . . 63.0 110.503 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.9 ttpt -118.36 135.88 54.06 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.194 -0.299 . . . . 70.34 110.194 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -144.43 172.82 12.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.125 0.488 . . . . 73.31 111.864 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.52 118.22 14.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.53 -0.759 . . . . 71.53 109.817 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.696 HD21 ' CE1' ' A' ' 216' ' ' PHE . 2.1 pt? -128.73 139.84 52.02 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.016 0.436 . . . . 65.24 111.795 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.559 ' HB3' HG23 ' A' ' 215' ' ' THR . 0.0 OUTLIER -117.79 114.87 23.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.792 -0.64 . . . . 75.24 110.544 179.549 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.449 HD13 HD11 ' A' ' 172' ' ' ILE . 3.1 mt -105.0 142.43 18.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.229 -0.441 . . . . 61.25 111.521 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.433 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.3 OUTLIER -72.05 168.57 21.78 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.907 -0.588 . . . . 74.25 110.592 179.818 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 194' ' ' PRO . . . . . 0.433 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 24.7 Cg_endo -61.93 -35.07 79.56 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.352 2.035 . . . . 61.03 112.224 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -60.37 -39.91 88.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 71.12 111.099 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.439 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 16.8 m0 -96.98 36.87 1.36 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.343 -0.39 . . . . 64.0 110.974 -179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -160.8 -78.45 0.05 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.067 -0.515 . . . . 61.34 110.742 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 198' ' ' TYR . . . . . 0.589 ' CE2' HD13 ' A' ' 208' ' ' ILE . 36.0 m-85 -105.98 -71.25 0.75 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 74.34 110.535 179.531 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 141.03 -177.21 21.11 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.815 -0.707 . . . . 32.35 112.85 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 18.4 mttm -59.21 -34.65 72.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.816 0.341 . . . . 72.43 110.932 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -61.57 -52.8 62.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 50.02 110.64 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 97.17 173.6 34.29 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.874 -0.679 . . . . 73.22 112.551 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.425 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.3 OUTLIER -111.23 93.51 18.61 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.654 0.264 . . . . 75.14 110.743 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.97 -26.37 51.32 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.527 2.151 . . . . 64.43 112.443 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -60.86 -42.18 97.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.946 0.403 . . . . 74.43 110.849 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -99.21 27.43 5.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.043 -0.526 . . . . 75.34 111.231 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.1 29.44 14.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.27 -0.423 . . . . 74.02 111.038 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.66 HG23 HD21 ' A' ' 139' ' ' LEU . 40.6 mt -94.14 111.46 53.39 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.317 -0.401 . . . . 62.52 110.987 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.33 172.32 6.65 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.554 2.169 . . . . 74.21 112.25 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.2 128.64 12.31 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.612 2.208 . . . . 72.33 112.241 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 5.5 m120 63.26 69.54 0.57 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.3 -0.409 . . . . 53.14 110.711 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.68 156.98 34.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 43.13 111.39 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -88.57 141.72 28.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.962 -0.563 . . . . 53.33 110.381 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.457 HD11 ' CD2' ' A' ' 198' ' ' TYR . 3.5 mt -125.68 109.07 12.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.379 . . . . 70.33 111.518 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.559 HG23 ' HB3' ' A' ' 191' ' ' GLU . 4.3 m -113.07 142.9 45.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.953 -0.567 . . . . 44.42 110.511 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.696 ' CE1' HD21 ' A' ' 190' ' ' LEU . 18.4 p90 -155.08 -179.86 8.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.438 . . . . 74.54 111.371 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -132.53 135.96 46.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.702 -0.681 . . . . 73.4 110.409 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.695 HG21 ' HE1' ' A' ' 175' ' ' TRP . 4.2 t -121.14 150.9 24.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.098 0.475 . . . . 64.42 111.809 -178.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -136.74 107.96 6.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.654 -0.703 . . . . 72.21 110.163 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.736 HD21 HG13 ' A' ' 223' ' ' ILE . 2.3 tt -69.99 130.0 41.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.426 -0.352 . . . . 64.44 110.809 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 24.7 t -108.8 -30.14 2.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.253 -0.43 . . . . 73.23 111.423 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 222' ' ' ASP . . . . . 0.431 ' N ' HD23 ' A' ' 220' ' ' LEU . 7.8 t70 -170.0 160.16 8.1 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.901 0.381 . . . . 64.44 111.236 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.736 HG13 HD21 ' A' ' 220' ' ' LEU . 31.9 mt -142.83 111.82 2.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.03 -0.532 . . . . 54.35 111.014 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 224' ' ' ASP . . . . . 0.434 ' C ' HG12 ' A' ' 130' ' ' VAL . 1.1 m-20 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.243 -0.435 . . . . 74.43 110.902 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 mpp? . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.826 0.346 . . . . 64.4 111.207 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -175.13 116.31 0.16 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 71.41 111.092 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.611 ' O ' ' HB2' ' A' ' 4' ' ' ALA . . . -67.35 -177.28 0.68 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.227 -0.442 . . . . 72.32 111.118 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.611 ' HB2' ' O ' ' A' ' 3' ' ' ALA . . . 163.23 86.47 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.11 -0.496 . . . . 63.33 111.065 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.939 HG11 HG21 ' A' ' 136' ' ' THR . 40.0 t -87.61 110.76 37.07 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.521 -0.309 . . . . 41.45 110.846 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.451 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 88.9 Cg_endo -80.9 140.2 12.6 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.622 2.215 . . . . 72.05 112.623 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -83.87 154.62 23.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 62.42 110.863 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.57 89.92 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.114 -0.493 . . . . 65.42 111.47 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.83 -32.38 67.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 62.4 111.18 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.557 ' NE1' HD11 ' A' ' 20' ' ' LEU . 1.9 m-90 -118.63 173.86 6.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 74.33 110.927 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.465 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -116.66 153.08 32.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.962 -0.563 . . . . 70.25 110.424 179.542 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.533 HG11 ' HG3' ' A' ' 154' ' ' LYS . 24.1 t -55.96 -33.74 36.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.926 0.394 . . . . 55.11 111.009 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -71.13 -27.67 63.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.986 -0.552 . . . . 72.03 111.286 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.465 ' HB2' HG23 ' A' ' 11' ' ' THR . 0.0 OUTLIER -82.34 -56.38 3.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.811 0.339 . . . . 73.35 111.208 -179.82 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.763 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.2 mt -49.51 -65.07 0.63 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.245 -0.434 . . . . 61.12 111.228 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.408 ' HD2' HG12 ' A' ' 12' ' ' VAL . 16.0 mtt180 -53.55 -25.1 15.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 71.21 111.258 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.69 172.72 0.16 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.941 0.401 . . . . 72.31 111.239 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -110.3 16.84 21.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.92 -0.582 . . . . 53.4 111.254 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -111.34 -23.58 10.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.568 -0.287 . . . . 71.52 111.224 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.849 HD22 HD11 ' A' ' 25' ' ' ILE . 10.1 tt -87.12 116.52 66.35 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.458 -0.337 . . . . 62.25 110.921 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.45 123.27 13.22 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.384 2.056 . . . . 55.45 112.237 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.4 -24.11 66.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 72.23 111.308 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -53.16 -35.24 59.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.421 -0.354 . . . . 64.23 111.295 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -77.56 -49.74 14.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.287 -0.415 . . . . 72.11 110.921 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.849 HD11 HD22 ' A' ' 20' ' ' LEU . 25.1 mt -47.03 -36.91 3.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.898 -0.592 . . . . 72.23 111.246 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.736 HG12 HD21 ' A' ' 59' ' ' LEU . 10.7 mt -72.04 -49.26 45.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 42.31 110.848 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.539 ' HG3' HD11 ' A' ' 47' ' ' ILE . 0.7 OUTLIER -57.23 -23.43 48.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.69 -0.687 . . . . 71.42 111.098 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -74.23 -49.78 21.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.002 0.43 . . . . 73.5 111.061 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.789 HD21 ' HA ' ' A' ' 63' ' ' TYR . 3.5 mt -66.3 -28.55 68.77 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.872 -0.603 . . . . 44.44 111.291 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -76.21 -28.01 57.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.52 -0.309 . . . . 64.44 111.016 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.423 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 10.7 pt-20 -89.91 -38.48 13.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.832 0.348 . . . . 71.32 110.817 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.451 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 42.4 m170 -100.49 16.61 24.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 64.32 110.982 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.6 152.11 21.49 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.831 -0.7 . . . . 63.44 112.512 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.8 p -92.73 156.52 16.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.642 0.258 . . . . 75.42 110.604 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.438 ' HA ' HD21 ' A' ' 44' ' ' LEU . 1.4 m-20 -48.0 -54.68 12.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.765 0.316 . . . . 65.23 111.31 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 82.5 p -51.06 -46.69 61.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.023 0.439 . . . . 75.33 110.695 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 22.2 t80 -57.11 -48.18 79.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.745 -0.661 . . . . 64.14 110.775 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.751 HD22 ' HB3' ' A' ' 43' ' ' LEU . 11.8 mt -63.24 -46.87 84.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 71.53 110.909 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.913 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -49.46 -31.05 9.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 41.25 111.243 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -72.92 -32.46 65.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 71.21 111.073 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.707 ' ND1' ' HB2' ' A' ' 62' ' ' ALA . 6.7 m-70 -110.14 12.14 23.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.377 -0.374 . . . . 75.44 111.548 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 59.96 32.13 20.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.747 0.308 . . . . 70.32 111.01 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.751 ' HB3' HD22 ' A' ' 38' ' ' LEU . 15.5 mt -85.93 -22.05 27.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.257 -0.429 . . . . 74.12 111.042 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.913 HD11 ' HB2' ' A' ' 39' ' ' ALA . 92.4 mt -48.01 170.47 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.931 0.396 . . . . 63.11 111.234 179.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.88 -160.13 32.15 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.846 -0.692 . . . . 63.23 112.796 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.877 ' O ' HG23 ' A' ' 50' ' ' VAL . 36.7 m-80 -102.62 147.11 27.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.963 0.411 . . . . 72.44 111.065 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.587 HG23 HD12 ' A' ' 26' ' ' ILE . 3.3 mp -45.36 -43.59 3.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.889 -0.596 . . . . 74.34 111.513 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -43.15 72.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.981 -0.554 . . . . 73.35 111.047 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -85.68 -28.95 24.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.956 -0.565 . . . . 73.24 111.22 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.877 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.8 t -73.01 -27.57 24.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.299 -0.41 . . . . 74.14 111.454 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.51 -25.86 66.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.427 -0.351 . . . . 54.35 111.359 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.25 -27.38 15.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.287 -0.415 . . . . 75.31 111.244 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.4 m -84.33 -21.43 30.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.353 -0.385 . . . . 74.33 111.414 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -120.58 131.48 54.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.795 0.331 . . . . 72.13 111.349 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -77.81 -178.12 5.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 52.2 110.474 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.465 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -61.28 -58.42 8.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.816 0.341 . . . . 72.53 110.536 179.962 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.24 -26.72 67.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.143 -0.481 . . . . 72.45 110.664 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.67 -37.95 83.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.108 0.48 . . . . 72.4 110.249 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.736 HD21 HG12 ' A' ' 26' ' ' ILE . 14.2 mt -76.25 -31.71 58.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.614 -0.721 . . . . 73.11 110.955 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.763 HG22 ' HB3' ' A' ' 15' ' ' LEU . 15.1 t -78.46 -42.81 26.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.051 0.453 . . . . 71.34 110.705 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 32.8 m -59.27 -35.6 74.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.842 -0.617 . . . . 72.51 110.493 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.707 ' HB2' ' ND1' ' A' ' 41' ' ' HIS . . . -81.76 -20.85 38.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.024 -0.535 . . . . 74.24 110.957 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.789 ' HA ' HD21 ' A' ' 29' ' ' LEU . 8.2 t80 -83.67 -22.99 31.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.194 -0.457 . . . . 71.52 110.86 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.508 ' ND2' HG12 ' A' ' 60' ' ' VAL . 37.1 m-80 -85.6 -53.91 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 74.24 111.369 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.449 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.2 p-80 -60.99 -28.29 68.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.111 -0.495 . . . . 73.43 111.136 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.67 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.8 tt -50.27 -40.51 48.35 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.977 0.417 . . . . 62.22 110.973 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.418 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.4 m-85 -78.95 -37.48 39.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.892 -0.594 . . . . 63.31 110.578 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.04 -40.47 91.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.893 -0.594 . . . . 74.31 110.999 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.01 -9.53 48.29 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.076 -0.511 . . . . 71.54 111.278 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.59 33.73 19.79 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.741 0.305 . . . . 74.23 111.244 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -90.56 46.29 1.32 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.387 -0.37 . . . . 74.15 111.078 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.428 ' CE2' ' HD2' ' A' ' 6' ' ' PRO . 93.3 m-85 -67.32 169.77 8.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.293 -0.412 . . . . 75.25 110.742 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.1 ttmm -66.59 125.94 27.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.329 -0.396 . . . . 61.43 110.861 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -96.99 27.97 15.92 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.703 -0.76 . . . . 73.33 112.527 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.493 HG22 ' H ' ' A' ' 76' ' ' GLU . 0.2 OUTLIER 60.14 178.93 0.09 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.832 0.349 . . . . 70.21 110.859 179.982 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.493 ' H ' HG22 ' A' ' 75' ' ' THR . 5.2 mm-40 -157.46 -45.16 0.07 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.193 -0.458 . . . . 64.31 110.941 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.56 ' O ' HG23 ' A' ' 78' ' ' ILE . 63.9 p -126.86 122.1 33.73 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.061 -0.518 . . . . 53.33 110.914 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.56 HG23 ' O ' ' A' ' 77' ' ' SER . 8.1 pt -159.46 -42.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.474 . . . . 72.33 111.259 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 14.6 m -154.36 105.81 2.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.114 -0.493 . . . . 42.14 110.903 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -104.57 -178.54 3.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 74.43 110.896 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 27.7 t 63.93 116.56 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 72.15 111.056 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 79.6 p -160.9 -48.66 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 54.04 110.904 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -164.95 98.61 0.75 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 72.43 110.871 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.81 162.81 23.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 64.41 110.941 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -126.42 96.66 3.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 70.0 111.11 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.18 141.73 36.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 71.32 110.831 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -103.01 -32.89 9.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 62.33 110.922 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.449 ' HB ' HD23 ' A' ' 90' ' ' LEU . 15.2 m -89.86 153.08 3.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.445 . . . . 72.34 111.15 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -104.73 64.52 0.74 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 64.55 110.845 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.449 HD23 ' HB ' ' A' ' 88' ' ' VAL . 4.4 mm? -111.28 -33.22 6.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.459 . . . . 53.45 110.918 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -106.35 -31.73 8.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.473 . . . . 44.21 110.927 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -78.82 126.28 30.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.455 . . . . 61.43 110.865 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -163.72 151.73 13.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 75.11 110.929 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.0 mttt 60.14 78.61 0.32 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 73.12 110.873 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.35 -27.38 30.93 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.574 2.183 . . . . 75.13 112.342 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 7.0 tptm -70.65 -35.38 72.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 73.51 110.903 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 59.3 107.95 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.171 -0.468 . . . . 73.3 110.954 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 12.1 p -129.95 110.17 11.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.444 . . . . 73.23 110.905 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.2 -31.38 7.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 64.44 110.897 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.8 m -96.64 -169.68 1.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 61.11 110.887 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -172.19 -41.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 74.32 110.869 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -88.82 -178.52 5.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.091 -0.504 . . . . 53.35 110.912 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.9 m -161.76 154.42 20.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 64.14 110.899 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.5 mp -97.49 169.61 9.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 72.4 110.926 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -151.97 -169.58 3.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 53.23 110.858 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 63.78 -80.21 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 61.14 111.021 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 135.57 91.65 0.35 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.803 -0.713 . . . . 25.44 112.469 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.89 166.54 27.42 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.593 2.195 . . . . 63.12 112.317 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.433 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 32.9 Cg_exo -57.85 -158.35 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.627 2.218 . . . . 73.02 112.31 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.26 39.13 1.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.271 -0.422 . . . . 75.52 110.893 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.433 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 6.2 p90 -173.03 153.82 2.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 53.53 110.897 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 19.7 m -115.85 130.55 56.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.276 -0.42 . . . . 72.22 110.327 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.527 ' HE2' HG22 ' A' ' 115' ' ' VAL . 4.6 tttt -127.65 144.85 51.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.926 0.393 . . . . 74.52 111.227 -179.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.3 m -142.51 119.81 11.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 74.52 110.681 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.527 HG22 ' HE2' ' A' ' 113' ' ' LYS . 27.5 t -80.29 106.36 11.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.431 . . . . 73.22 111.211 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.532 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -79.33 -49.36 12.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.214 -0.448 . . . . 71.1 110.795 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -121.8 107.99 12.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 75.34 110.957 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.6 mttm -63.03 143.63 57.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.223 -0.444 . . . . 71.44 110.895 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -106.15 -165.05 23.0 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.687 -0.768 . . . . 65.13 112.409 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -36.56 -42.57 0.36 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.846 0.355 . . . . 64.22 111.826 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.6 tttt 74.55 42.22 0.31 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.135 -0.484 . . . . 74.54 110.582 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 69.1 m -164.26 -43.37 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.946 -0.57 . . . . 62.12 110.722 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -86.83 101.12 13.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 72.11 110.911 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -120.24 147.67 45.47 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 72.23 110.834 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.456 ' CB ' HG21 ' A' ' 166' ' ' VAL . 50.7 Cg_exo -54.37 127.63 26.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.56 2.174 . . . . 54.2 112.547 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.56 ' O ' HG23 ' A' ' 166' ' ' VAL . 1.1 mttp -99.18 152.19 20.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 74.31 110.706 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.48 114.05 1.52 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.335 -0.393 . . . . 74.53 111.114 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 93.44 -2.37 70.64 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.762 -0.732 . . . . 62.45 112.982 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -92.15 137.77 32.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.919 0.39 . . . . 71.0 111.071 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.518 HG22 ' N ' ' A' ' 131' ' ' VAL . 7.5 p -70.05 161.27 4.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.078 -0.51 . . . . 75.52 110.971 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.751 HG12 HG23 ' A' ' 223' ' ' ILE . 5.5 m -153.58 144.71 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 72.22 111.07 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.475 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.96 117.75 22.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.543 -0.299 . . . . 65.13 110.805 179.753 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.5 ' HA ' HG23 ' A' ' 221' ' ' VAL . 30.2 p -150.12 168.09 24.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.0 0.429 . . . . 53.14 111.182 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.718 ' HB3' HD11 ' A' ' 149' ' ' ILE . 51.3 m95 -101.89 157.76 16.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.813 -0.63 . . . . 73.11 109.747 179.326 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.471 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 49.8 p90 -162.45 139.06 7.78 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.296 -0.561 . . . . 64.15 112.22 -179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.939 HG21 HG11 ' A' ' 5' ' ' VAL . 81.1 m -129.26 112.48 13.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.466 -0.788 . . . . 71.24 110.457 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.648 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.73 146.15 18.11 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.598 -0.81 . . . . 62.23 113.184 -179.524 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.635 HG23 HG12 ' A' ' 144' ' ' VAL . 0.0 OUTLIER -152.21 147.1 26.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.789 0.328 . . . . 74.21 110.833 179.815 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.686 HD21 HD12 ' A' ' 208' ' ' ILE . 41.4 mt -80.5 -178.37 6.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 74.14 110.694 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -56.92 -43.82 81.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.901 0.382 . . . . 71.13 111.018 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.7 -6.61 47.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.996 -0.547 . . . . 65.4 111.462 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' GLY . . . . . 0.438 ' HA2' ' HB2' ' A' ' 3' ' ' ALA . . . 92.43 20.45 35.04 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.666 -0.778 . . . . 63.54 112.729 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.48 113.8 25.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 73.11 110.675 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.635 HG12 HG23 ' A' ' 138' ' ' THR . 5.7 m -63.68 138.5 22.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 64.04 111.134 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.675 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 40.3 p90 -117.81 -40.96 2.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 60.45 110.929 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -154.53 115.2 3.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.067 -0.515 . . . . 75.03 110.715 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.406 ' CB ' ' HA ' ' A' ' 136' ' ' THR . 6.9 t -142.76 126.97 17.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.302 -0.408 . . . . 64.4 111.237 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.502 ' O ' HD13 ' A' ' 149' ' ' ILE . 24.1 t-20 -89.01 55.44 3.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.196 0.522 . . . . 73.32 109.915 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.718 HD11 ' HB3' ' A' ' 134' ' ' TRP . 45.3 mm -131.62 96.45 2.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.74 -0.664 . . . . 74.41 111.05 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -90.6 -75.32 0.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 74.43 110.912 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 4.6 m -146.5 165.98 27.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 61.03 110.946 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.4 m -89.26 171.01 10.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 74.02 110.89 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.02 -30.59 34.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 71.12 111.086 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' LYS . . . . . 0.533 ' HG3' HG11 ' A' ' 12' ' ' VAL . 3.8 tmtt? -59.66 -31.82 69.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 73.1 110.943 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -86.92 -34.72 19.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 74.44 110.917 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -177.66 139.47 0.24 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 63.42 110.918 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.29 74.16 2.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 74.21 110.864 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -146.77 61.23 1.2 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 73.41 110.86 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.437 ' HB1' ' HH2' ' A' ' 134' ' ' TRP . . . -150.68 139.16 20.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.15 -0.477 . . . . 73.24 111.094 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.4 tttt -146.34 116.06 4.65 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.446 . . . . 43.34 110.855 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.42 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 53.8 Cg_exo -52.41 155.05 10.31 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.376 2.05 . . . . 65.54 112.258 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.65 117.83 16.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 75.12 110.517 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.637 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -100.6 123.31 44.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.939 0.399 . . . . 72.13 111.474 -179.733 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.704 ' O ' HG22 ' A' ' 131' ' ' VAL . 11.7 p90 -153.38 145.41 23.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.965 -0.561 . . . . 73.31 110.528 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.601 ' O ' HG22 ' A' ' 168' ' ' VAL . 9.6 mtpt -81.17 138.9 35.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.136 0.493 . . . . 75.33 111.248 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 126' ' ' LYS . 6.2 m -87.3 149.37 4.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.566 -0.743 . . . . 63.5 111.128 -179.434 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.63 22.82 78.04 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.836 -0.697 . . . . 74.34 112.6 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 165' ' ' LYS . 28.0 m -131.24 40.52 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.35 . . . . 65.42 111.111 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.52 38.06 6.94 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 121.071 -0.585 . . . . 53.03 113.135 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.51 -47.0 11.81 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.94 0.4 . . . . 64.22 110.983 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 171' ' ' VAL . . . . . 0.467 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.3 OUTLIER -119.0 -179.48 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.001 -0.545 . . . . 64.21 111.026 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.537 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.8 158.89 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.316 -0.402 . . . . 73.33 111.281 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 17.0 ttm105 -67.73 -27.88 67.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.271 -0.422 . . . . 75.13 110.965 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.1 -38.06 48.17 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.694 -0.765 . . . . 72.11 111.881 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.775 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.2 t90 -78.6 -33.0 47.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.993 0.425 . . . . 74.11 110.883 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 176' ' ' ASP . . . . . 0.402 ' O ' HD13 ' A' ' 180' ' ' LEU . 35.9 t70 -64.91 -32.17 73.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.877 -0.601 . . . . 72.24 110.538 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -80.84 -28.93 35.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.055 -0.52 . . . . 71.31 110.665 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.533 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -80.7 -56.36 4.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 65.33 111.059 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.691 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 6.2 mt -56.01 -31.3 62.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.924 -0.58 . . . . 61.44 110.797 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.402 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.4 tp -53.41 -28.88 32.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.085 -0.507 . . . . 72.34 111.344 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 27.1 p -105.65 4.59 30.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.372 -0.376 . . . . 74.52 111.793 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.474 ' O ' HD13 ' A' ' 220' ' ' LEU . 5.3 mtp -74.33 101.98 4.23 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.903 0.383 . . . . 75.15 110.89 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.9 161.39 18.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.927 -0.579 . . . . 72.3 111.409 -179.059 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 184' ' ' LYS . . . . . 0.642 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -60.86 117.65 5.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.56 -0.745 . . . . 74.13 111.2 -179.769 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 81.65 10.42 84.33 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.869 -0.682 . . . . 64.05 113.137 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -86.18 151.07 23.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 71.21 111.27 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -127.42 138.16 52.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.998 -0.546 . . . . 64.4 109.976 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.05 172.5 13.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.226 0.536 . . . . 75.34 112.147 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.82 101.09 4.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.391 -0.822 . . . . 75.13 109.715 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.533 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.6 pt? -122.18 147.94 45.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.121 0.486 . . . . 70.1 111.881 -179.04 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.619 ' HB3' HG23 ' A' ' 215' ' ' THR . 10.5 pt-20 -120.47 120.53 36.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.705 -0.68 . . . . 64.12 110.564 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.471 ' CD1' ' CZ ' ' A' ' 216' ' ' PHE . 5.0 mp -100.49 139.46 21.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 64.55 111.347 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -77.0 164.88 56.41 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.933 -0.576 . . . . 72.21 110.756 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 194' ' ' PRO . . . . . 0.41 ' HG3' ' N ' ' A' ' 212' ' ' ALA . 53.1 Cg_exo -54.93 -42.0 73.25 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.588 2.192 . . . . 72.34 112.303 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -52.29 -30.41 27.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 72.03 111.379 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.461 ' O ' HG21 ' A' ' 192' ' ' ILE . 23.7 m0 -115.6 36.95 3.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.404 -0.362 . . . . 74.32 111.227 -179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -154.93 -85.2 0.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.447 -0.342 . . . . 71.41 111.25 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 198' ' ' TYR . . . . . 0.519 ' HD2' HG21 ' A' ' 208' ' ' ILE . 28.7 m-85 -107.55 -33.47 7.32 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.043 0.449 . . . . 75.42 110.624 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 109.29 173.1 20.95 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.912 -0.661 . . . . 31.11 112.821 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -32.57 70.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.788 0.328 . . . . 62.04 110.831 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -56.78 -54.71 43.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.203 -0.453 . . . . 64.33 110.643 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 117.87 -162.4 13.08 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.833 -0.699 . . . . 72.02 112.673 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.438 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 1.6 tm0? -153.02 84.99 4.37 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.85 0.357 . . . . 70.23 110.355 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -48.67 -49.67 14.26 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.803 2.335 . . . . 71.34 113.048 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -50.93 -42.32 59.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.914 0.388 . . . . 72.14 111.088 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.675 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -95.65 26.75 3.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.033 -0.53 . . . . 73.35 111.384 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 4.0 mptt 47.84 30.68 1.99 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.83 0.348 . . . . 65.44 111.075 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.686 HD12 HD21 ' A' ' 139' ' ' LEU . 22.7 mm -92.81 111.71 52.48 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 74.25 111.28 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 209' ' ' PRO . . . . . 0.567 ' HG2' ' HB2' ' A' ' 212' ' ' ALA . 74.4 Cg_endo -74.99 160.88 39.67 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.414 2.076 . . . . 75.31 112.17 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -51.33 115.3 1.98 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.473 2.115 . . . . 71.3 112.298 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 66.24 73.53 0.37 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.232 -0.44 . . . . 62.34 110.912 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 212' ' ' ALA . . . . . 0.567 ' HB2' ' HG2' ' A' ' 209' ' ' PRO . . . -126.22 124.68 40.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.248 -0.433 . . . . 74.03 111.329 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 3.8 tptm -65.67 151.82 45.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.106 -0.497 . . . . 72.51 110.578 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 6.1 mt -130.48 109.42 10.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.814 0.34 . . . . 70.33 111.405 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.619 HG23 ' HB3' ' A' ' 191' ' ' GLU . 3.8 m -106.38 139.72 40.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 62.53 110.573 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.648 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 6.4 p90 -156.44 178.75 9.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.107 0.48 . . . . 62.31 111.514 -179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -133.01 137.13 46.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.613 -0.721 . . . . 74.34 110.279 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.775 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.3 t -124.15 151.26 29.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.107 0.48 . . . . 54.35 112.086 -178.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -136.88 110.98 8.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.598 -0.728 . . . . 61.25 110.132 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.792 HD21 HG13 ' A' ' 223' ' ' ILE . 2.9 tt -70.83 128.04 34.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.84 0.352 . . . . 70.11 110.988 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.5 HG23 ' HA ' ' A' ' 133' ' ' CYS . 15.5 t -104.97 -30.43 2.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.125 -0.488 . . . . 60.12 111.571 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -171.21 162.46 6.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.867 0.365 . . . . 74.31 111.239 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.792 HG13 HD21 ' A' ' 220' ' ' LEU . 30.2 mt -143.49 112.23 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.006 -0.543 . . . . 64.15 110.964 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 224' ' ' ASP . . . . . 0.491 ' C ' HG12 ' A' ' 130' ' ' VAL . 3.3 m-20 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 72.44 110.89 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 mpp? . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.873 0.368 . . . . 74.53 111.189 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -147.87 165.19 31.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 51.01 111.118 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.451 ' O ' ' HB3' ' A' ' 4' ' ' ALA . . . 59.64 174.48 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 74.12 111.099 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 3' ' ' ALA . . . 69.78 158.55 0.17 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.188 -0.46 . . . . 74.25 111.058 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 1.091 HG11 HG21 ' A' ' 136' ' ' THR . 38.5 t -95.17 114.19 63.19 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 73.32 111.217 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -77.12 132.89 13.04 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.731 2.287 . . . . 72.25 112.401 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.8 ' OE1' HD11 ' A' ' 149' ' ' ILE . 7.2 mm100 -79.79 146.54 32.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 71.12 110.943 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.523 ' HE ' HG23 ' A' ' 149' ' ' ILE . 0.0 OUTLIER -50.81 115.63 1.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.036 -0.529 . . . . 74.32 111.192 -179.829 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.43 ' HB2' ' NZ ' ' A' ' 187' ' ' LYS . . . -89.25 -39.39 13.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.226 -0.443 . . . . 70.11 110.871 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.517 ' NE1' HD21 ' A' ' 20' ' ' LEU . 1.5 m-90 -104.36 160.05 15.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.023 -0.535 . . . . 72.14 110.703 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 m -99.26 151.87 20.55 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.048 -0.524 . . . . 60.1 110.533 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.635 ' HA ' HD12 ' A' ' 15' ' ' LEU . 44.0 t -56.67 -37.0 50.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.922 0.392 . . . . 75.52 110.437 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.403 ' O ' ' HB2' ' A' ' 17' ' ' SER . 2.1 tt0 -66.02 -27.4 68.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.962 -0.563 . . . . 72.54 110.86 179.5 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.544 ' OE1' HD23 ' A' ' 20' ' ' LEU . 6.3 mt-30 -80.08 -54.53 5.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.985 -0.552 . . . . 73.21 111.564 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.756 ' HB3' HG22 ' A' ' 60' ' ' VAL . 2.0 mt -50.07 -66.69 0.35 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.727 0.298 . . . . 71.33 111.797 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 12' ' ' VAL . 1.5 ptm180 -60.59 -26.21 66.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.383 -0.371 . . . . 71.31 111.371 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.433 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.4 OUTLIER -50.85 177.28 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.928 0.394 . . . . 55.51 111.273 -179.92 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.19 16.68 21.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.946 -0.57 . . . . 74.31 111.107 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -117.6 -19.32 9.44 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.418 -0.356 . . . . 71.13 111.273 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 1.122 HD12 HD11 ' A' ' 25' ' ' ILE . 1.6 tm? -84.58 121.74 74.87 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.508 -0.315 . . . . 64.43 110.852 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.656 ' HD2' HD22 ' A' ' 20' ' ' LEU . 43.7 Cg_endo -67.84 123.25 10.49 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.428 2.086 . . . . 62.34 112.369 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.624 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -66.15 -24.23 66.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.11 -0.495 . . . . 61.33 111.403 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -53.43 -45.56 69.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.411 -0.358 . . . . 75.34 111.494 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.98 -23.29 48.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.162 -0.472 . . . . 71.43 111.475 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 1.122 HD11 HD12 ' A' ' 20' ' ' LEU . 57.1 mt -70.74 -43.22 77.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.925 0.393 . . . . 74.23 111.127 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.744 ' HB ' HG23 ' A' ' 47' ' ' ILE . 4.0 mt -68.72 -40.19 81.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.017 -0.538 . . . . 73.43 111.102 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -67.18 -25.83 66.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.001 -0.545 . . . . 75.04 111.062 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -70.04 -43.76 70.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.033 0.444 . . . . 54.05 110.875 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.562 HD21 ' HA ' ' A' ' 63' ' ' TYR . 2.8 mt -72.79 -21.35 61.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.888 -0.597 . . . . 74.42 111.04 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -82.68 -24.13 33.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.412 -0.358 . . . . 75.0 111.029 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.82 1.65 31.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.374 -0.375 . . . . 72.42 111.417 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -131.86 -10.66 3.45 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.687 0.255 . . . . 71.51 111.687 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.81 167.66 12.48 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.738 -0.744 . . . . 51.31 112.41 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.7 p -93.86 149.87 20.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.58 0.229 . . . . 74.12 110.489 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.624 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -48.07 -56.98 6.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.807 0.337 . . . . 74.55 110.994 -179.75 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.2 m -48.41 -50.7 29.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 72.15 110.832 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.512 ' CE2' HD12 ' A' ' 66' ' ' LEU . 17.6 t80 -54.06 -48.03 71.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.853 -0.612 . . . . 70.43 110.492 179.605 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.411 HD22 ' HB3' ' A' ' 43' ' ' LEU . 13.2 mt -66.71 -41.79 87.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.094 -0.503 . . . . 72.31 110.784 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.808 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.57 -47.71 28.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.989 0.423 . . . . 63.43 111.206 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -57.51 -27.22 62.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.812 -0.631 . . . . 74.44 110.982 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -112.53 9.81 19.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.314 -0.403 . . . . 62.01 111.231 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.4 37.77 28.27 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.94 0.4 . . . . 64.32 110.664 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.696 HD21 HD23 ' A' ' 59' ' ' LEU . 17.7 mt -95.94 -19.74 19.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.986 -0.552 . . . . 61.44 111.851 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.808 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -82.11 155.76 24.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.078 0.466 . . . . 71.33 111.101 -179.853 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.37 -122.63 5.5 Favored Glycine 0 N--CA 1.452 -0.292 0 CA-C-N 115.648 -0.705 . . . . 74.43 112.429 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.667 ' O ' HG23 ' A' ' 50' ' ' VAL . 6.0 m-80 -116.34 115.43 25.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.736 0.303 . . . . 63.45 111.059 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.744 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.5 mp -44.85 -53.5 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.178 -0.465 . . . . 75.1 111.447 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.56 -37.2 7.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.868 -0.605 . . . . 75.44 111.05 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -85.69 -26.58 25.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 72.11 111.255 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.667 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.4 t -82.79 -26.56 8.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.432 -0.349 . . . . 71.52 111.597 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.95 -17.85 64.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.427 -0.351 . . . . 61.34 111.454 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 ptpt -95.06 -31.96 13.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.445 -0.343 . . . . 71.2 111.09 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -87.88 -33.68 18.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.24 -0.436 . . . . 75.21 111.131 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -91.21 128.58 37.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.29 -0.414 . . . . 71.21 111.239 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -84.88 178.63 7.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 53.1 110.678 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.576 ' O ' HG23 ' A' ' 60' ' ' VAL . 2.4 tptt -60.03 -58.1 10.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.91 0.386 . . . . 75.34 110.653 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -27.4 69.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.072 -0.513 . . . . 63.54 110.522 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.02 -41.45 96.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 32.13 110.431 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.696 HD23 HD21 ' A' ' 43' ' ' LEU . 20.3 mt -75.55 -30.15 59.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.7 -0.682 . . . . 74.52 110.99 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.756 HG22 ' HB3' ' A' ' 15' ' ' LEU . 18.8 t -78.26 -42.91 27.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.305 -0.407 . . . . 73.5 110.93 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.7 m -61.98 -33.92 75.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.948 -0.569 . . . . 72.43 110.792 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.423 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -80.86 -23.49 39.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 62.14 111.107 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.562 ' HA ' HD21 ' A' ' 29' ' ' LEU . 71.8 t80 -83.66 -22.86 32.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 74.11 110.953 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -82.88 -54.65 4.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.048 -0.524 . . . . 63.54 111.373 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.487 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 3.4 p-80 -63.0 -26.0 68.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.072 -0.513 . . . . 74.32 111.433 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.668 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.6 tt -54.57 -39.04 67.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.847 0.356 . . . . 73.1 111.026 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.422 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 5.2 m-85 -78.98 -38.16 37.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.106 -0.497 . . . . 70.32 110.574 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.63 -40.53 84.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.97 -0.559 . . . . 70.03 110.78 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 75.1 p -90.34 -4.66 56.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.95 -0.568 . . . . 72.13 111.467 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 48.36 37.73 9.19 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.703 0.287 . . . . 55.5 111.287 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.433 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 41.2 mtt180 -94.25 44.03 1.11 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.38 -0.373 . . . . 75.25 111.115 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.419 ' HA ' HD21 ' A' ' 66' ' ' LEU . 81.5 m-85 -65.69 -178.29 0.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 62.42 110.783 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -72.31 153.01 41.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.289 -0.414 . . . . 63.13 110.948 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -130.56 164.97 22.89 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.722 -0.751 . . . . 63.22 112.47 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 79.0 p -60.25 152.37 24.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.75 0.309 . . . . 75.34 110.928 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -144.39 -46.78 0.25 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 73.3 110.994 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.4 m -123.58 125.73 45.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.996 -0.547 . . . . 62.24 110.899 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 3.9 mp -112.15 -33.28 2.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.182 -0.463 . . . . 74.21 111.142 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.47 160.36 15.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 64.4 110.912 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.24 -33.59 6.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 63.43 110.892 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.0 m -118.07 146.71 22.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 64.34 111.129 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.8 m -176.65 138.02 0.28 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 61.43 110.928 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 60.78 158.66 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 75.13 110.946 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.688 ' O ' HG13 ' A' ' 85' ' ' VAL . 2.2 tt0 61.19 154.8 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 63.43 110.962 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.688 HG13 ' O ' ' A' ' 84' ' ' GLN . 0.3 OUTLIER -165.9 102.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.896 -0.593 . . . . 64.44 111.095 -179.717 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.8 ttpp -143.96 138.45 28.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.209 -0.45 . . . . 75.04 110.9 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -176.63 97.38 0.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 40.24 110.939 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.56 HG12 ' H ' ' A' ' 91' ' ' ASN . 20.5 t 63.82 141.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.464 . . . . 74.11 111.065 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.35 -34.03 10.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.479 . . . . 61.43 110.917 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.538 ' H ' HD23 ' A' ' 90' ' ' LEU . 0.5 OUTLIER -72.08 -31.12 65.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 75.41 110.921 -179.973 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.56 ' H ' HG12 ' A' ' 88' ' ' VAL . 2.5 m120 -133.86 175.97 8.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 72.32 110.878 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -176.38 131.42 0.22 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.47 . . . . 63.13 110.889 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -132.52 161.52 33.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 73.3 110.869 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.9 mttt -106.25 86.53 2.11 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 63.2 110.883 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.02 143.21 48.89 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.572 2.181 . . . . 54.35 112.286 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.58 140.04 40.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 74.5 110.88 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -132.25 139.99 48.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 74.43 110.893 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.6 t -104.47 142.74 34.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 74.21 110.971 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -108.23 -31.5 7.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 65.31 110.905 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.1 m -96.9 177.21 5.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 74.05 110.897 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -176.59 105.1 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 74.12 110.875 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -150.12 -177.51 5.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 75.01 110.921 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 6.2 m 63.59 126.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.165 -0.471 . . . . 70.14 110.922 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.74 -168.87 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 73.04 110.873 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -110.17 -31.47 7.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.196 -0.456 . . . . 61.14 110.894 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -78.67 -33.23 47.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 74.01 110.919 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 96.8 67.68 0.95 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.765 -0.731 . . . . 65.1 112.49 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -68.96 171.27 13.87 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.615 2.21 . . . . 62.41 112.284 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.44 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 31.4 Cg_endo -63.87 -166.73 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.581 2.187 . . . . 60.34 112.258 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.441 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -97.84 30.07 3.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 74.54 110.987 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.44 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 45.0 p90 -154.89 -176.81 6.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 74.43 110.81 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -161.46 104.93 1.26 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.332 -0.394 . . . . 61.14 110.733 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.405 ' HB2' ' CD1' ' A' ' 190' ' ' LEU . 2.7 ptmm? -98.46 151.4 20.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.983 0.42 . . . . 72.23 111.241 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 2.1 m -148.61 111.67 4.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.887 -0.597 . . . . 74.51 110.391 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 26.1 t -73.58 106.29 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.305 -0.407 . . . . 75.52 111.324 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.822 HD12 ' HA ' ' A' ' 188' ' ' ALA . 3.5 mp -75.54 -32.02 60.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 63.24 110.508 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.7 tttt -140.35 110.47 6.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.036 -0.529 . . . . 62.24 110.668 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.0 tptt -57.99 134.76 56.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.262 -0.426 . . . . 71.44 110.968 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.513 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -108.63 -155.08 17.23 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.713 -0.756 . . . . 75.32 112.425 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -36.07 -53.44 0.78 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.008 0.432 . . . . 63.42 111.445 -179.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 70.87 33.71 2.12 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.816 -0.629 . . . . 72.42 110.248 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 62.7 m -154.51 -45.13 0.09 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.753 -0.658 . . . . 54.2 110.683 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -89.08 92.57 9.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.119 -0.492 . . . . 63.5 110.84 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -102.83 154.91 37.18 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.117 -0.492 . . . . 61.23 110.847 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.709 ' HB2' HG21 ' A' ' 166' ' ' VAL . 53.9 Cg_endo -69.73 125.5 12.23 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.522 2.148 . . . . 62.2 112.332 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.432 ' O ' HG23 ' A' ' 166' ' ' VAL . 0.1 OUTLIER -96.44 152.42 18.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 75.12 110.925 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.48 118.98 6.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 74.14 110.859 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 97.36 -16.04 61.28 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.699 -0.763 . . . . 74.22 112.606 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -84.09 140.41 31.83 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.876 0.369 . . . . 74.0 110.969 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.557 HG12 ' C ' ' A' ' 224' ' ' ASP . 8.4 p -71.04 163.45 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 75.25 111.041 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.883 HG22 ' O ' ' A' ' 164' ' ' PHE . 13.0 m -154.91 146.26 13.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.171 -0.468 . . . . 74.02 111.063 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.601 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.0 OUTLIER -128.01 117.76 22.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.718 0.294 . . . . 75.1 110.838 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.465 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 26.1 p -155.27 170.18 22.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.927 0.394 . . . . 64.41 111.047 -179.623 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.771 ' HB3' HD13 ' A' ' 149' ' ' ILE . 38.2 m95 -106.08 164.6 11.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.949 -0.569 . . . . 74.22 110.308 179.584 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.504 ' OH ' HD13 ' A' ' 162' ' ' LEU . 12.3 p90 -162.08 137.07 7.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.926 0.394 . . . . 71.41 111.433 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' THR . . . . . 1.091 HG21 HG11 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -128.06 114.07 16.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.949 -0.568 . . . . 74.21 110.466 179.741 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.614 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.64 144.78 17.44 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.615 -0.802 . . . . 73.51 113.407 -179.184 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.885 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.95 136.78 18.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.702 0.286 . . . . 64.15 110.367 179.608 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 1.019 HD21 HD12 ' A' ' 208' ' ' ILE . 17.1 mt -68.45 -179.05 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.857 0.36 . . . . 73.2 111.035 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -57.04 -41.78 79.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.025 -0.534 . . . . 75.14 110.862 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.37 0.99 39.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 64.23 111.446 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 91.48 25.83 22.34 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.645 -0.788 . . . . 63.0 112.619 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.95 108.35 16.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.773 0.32 . . . . 75.3 110.835 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.418 HG13 ' O ' ' A' ' 144' ' ' VAL . 11.3 p -68.81 125.34 26.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 65.02 111.138 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.442 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 21.3 p90 -109.96 -22.2 11.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 73.1 111.002 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -162.06 137.9 7.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.401 -0.363 . . . . 75.15 110.836 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.905 HG23 HG23 ' A' ' 136' ' ' THR . 52.3 m -142.8 106.25 4.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 72.05 111.016 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.48 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 13.8 t30 -82.11 -14.81 55.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 71.34 111.226 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.8 HD11 ' OE1' ' A' ' 7' ' ' GLN . 25.4 mm -54.53 149.47 2.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.822 0.344 . . . . 73.33 111.096 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.538 ' HB3' ' HB1' ' A' ' 159' ' ' ALA . 0.0 OUTLIER -148.27 166.05 29.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 72.24 110.898 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 40.9 p -60.18 165.99 3.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.264 -0.426 . . . . 64.12 110.914 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.1 t -75.82 165.13 25.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 61.42 110.856 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.02 -30.56 34.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 73.14 111.104 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.49 -31.4 69.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 71.23 110.945 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 19.8 tptt -84.36 -31.54 24.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.913 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -175.06 122.39 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.449 . . . . 72.34 110.905 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -71.09 80.67 0.68 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 62.45 110.862 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -160.98 47.32 0.21 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 51.32 110.876 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.538 ' HB1' ' HB3' ' A' ' 150' ' ' GLN . . . -157.16 127.13 6.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.17 -0.468 . . . . 73.22 111.038 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -145.01 135.29 11.9 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 71.25 110.887 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.408 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 52.6 Cg_exo -54.68 163.49 3.86 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.445 2.097 . . . . 72.1 112.276 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.531 HD23 ' CD1' ' A' ' 164' ' ' PHE . 2.4 tt -84.54 119.41 25.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 72.42 110.595 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.626 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -95.17 121.79 37.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.897 0.379 . . . . 45.53 111.175 -179.93 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.883 ' O ' HG22 ' A' ' 131' ' ' VAL . 8.2 p90 -149.1 140.68 23.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.082 -0.508 . . . . 74.54 110.742 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.566 ' O ' HG22 ' A' ' 168' ' ' VAL . 56.1 mttt -80.68 137.41 36.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.076 0.465 . . . . 73.12 111.118 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.709 HG21 ' HB2' ' A' ' 125' ' ' PRO . 5.8 m -87.36 149.8 3.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.668 -0.696 . . . . 75.24 111.13 -179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.19 22.92 77.53 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.836 -0.697 . . . . 54.14 112.576 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.707 HG23 ' HG2' ' A' ' 170' ' ' LYS . 30.2 m -132.92 40.9 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.896 0.379 . . . . 52.52 111.032 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 49.12 38.85 26.0 Favored Glycine 0 CA--C 1.517 0.218 0 C-N-CA 120.936 -0.649 . . . . 71.14 112.896 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 170' ' ' LYS . . . . . 0.707 ' HG2' HG23 ' A' ' 168' ' ' VAL . 3.1 mmtt -83.02 -46.5 12.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.901 0.381 . . . . 75.1 110.78 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 171' ' ' VAL . . . . . 0.588 HG11 ' CE3' ' A' ' 175' ' ' TRP . 0.2 OUTLIER -123.35 -179.06 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.923 -0.581 . . . . 43.13 110.923 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.516 HD11 ' HB2' ' A' ' 175' ' ' TRP . 4.4 pt -57.16 161.37 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.316 -0.402 . . . . 53.04 111.382 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 31.8 ttm180 -69.7 -25.43 63.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 72.14 111.036 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -78.63 -38.55 23.98 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.743 -0.742 . . . . 51.44 112.187 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.648 ' HD1' HD23 ' A' ' 190' ' ' LEU . 3.4 t90 -75.66 -32.36 60.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.902 0.382 . . . . 64.52 111.36 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -72.04 -33.54 68.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.038 -0.528 . . . . 64.54 110.817 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -74.52 -28.98 61.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.115 -0.493 . . . . 63.13 110.83 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -87.98 -50.69 6.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.272 -0.422 . . . . 63.01 111.257 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.477 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 8.4 mt -52.55 -37.12 57.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.078 -0.51 . . . . 74.24 110.885 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 6.9 tp -50.97 -26.17 5.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.097 -0.501 . . . . 74.3 111.418 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.52 3.04 55.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.345 . . . . 73.43 111.624 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 4.7 ttt -79.95 148.99 30.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.752 0.311 . . . . 63.43 110.879 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -118.38 169.68 9.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.427 . . . . 73.13 111.26 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.76 118.52 8.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.859 -0.61 . . . . 73.0 110.659 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 68.01 64.1 3.31 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.687 -0.768 . . . . 43.44 112.476 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 186' ' ' GLU . . . . . 0.513 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 14.2 tt0 -144.02 147.7 34.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.575 0.226 . . . . 71.3 110.5 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 187' ' ' LYS . . . . . 0.529 ' HG2' HD13 ' A' ' 116' ' ' LEU . 6.1 tttt -115.94 132.83 56.53 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.066 -0.346 . . . . 74.14 110.066 179.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 188' ' ' ALA . . . . . 0.822 ' HA ' HD12 ' A' ' 116' ' ' LEU . . . -140.57 170.34 15.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.072 0.463 . . . . 73.25 111.729 -179.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 189' ' ' ARG . . . . . 0.568 ' HD3' HG23 ' A' ' 215' ' ' THR . 0.2 OUTLIER -123.08 101.39 7.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.653 -0.703 . . . . 72.05 109.892 179.548 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.648 HD23 ' HD1' ' A' ' 175' ' ' TRP . 4.9 mp -99.32 118.17 35.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.044 0.45 . . . . 75.3 112.106 -178.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.87 ' HG2' HG23 ' A' ' 215' ' ' THR . 9.4 mt-10 -110.72 107.71 17.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.666 -0.697 . . . . 62.44 109.574 178.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.454 HG12 ' CE2' ' A' ' 216' ' ' PHE . 3.6 mm -98.29 141.77 15.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.012 0.434 . . . . 74.01 111.639 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.402 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 2.0 mt-10 -81.53 166.66 36.65 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.868 -0.606 . . . . 70.31 110.372 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 194' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 21.1 Cg_endo -60.84 -48.72 9.96 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.427 2.084 . . . . 74.53 112.302 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -51.62 -26.32 8.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 54.52 111.442 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.441 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 10.1 m0 -117.61 37.02 4.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.487 -0.324 . . . . 75.44 111.216 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -158.01 -82.9 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.5 -0.318 . . . . 70.42 111.471 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 198' ' ' TYR . . . . . 0.782 ' CD2' HG21 ' A' ' 208' ' ' ILE . 22.7 m-85 -99.61 -30.36 12.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.855 0.36 . . . . 75.42 111.021 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 103.31 175.46 26.29 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.811 -0.709 . . . . 70.34 112.67 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 7.9 ttmt -57.6 -40.05 78.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.881 0.372 . . . . 74.32 110.848 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -44.6 96.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.059 -0.519 . . . . 70.22 110.607 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 109.14 -154.31 16.53 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.851 -0.69 . . . . 70.32 112.487 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.444 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.6 OUTLIER -139.82 87.3 12.91 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.718 0.294 . . . . 63.13 110.703 179.932 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.11 -22.12 67.64 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.54 2.16 . . . . 74.25 112.471 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.61 -42.11 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.882 0.372 . . . . 72.35 110.866 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -109.79 23.32 14.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.112 -0.494 . . . . 72.12 111.401 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt 56.36 54.4 7.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 61.24 111.067 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 1.019 HD12 HD21 ' A' ' 139' ' ' LEU . 20.2 mm -110.57 111.71 57.0 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 74.33 111.055 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.08 161.05 7.14 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.43 2.086 . . . . 50.32 112.342 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.18 129.35 15.97 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.594 2.196 . . . . 75.24 112.313 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 67.86 37.09 3.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.335 -0.393 . . . . 73.4 110.918 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -91.75 157.45 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.256 -0.429 . . . . 72.21 111.326 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.5 155.97 18.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 62.13 110.507 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.654 HD11 ' CD2' ' A' ' 198' ' ' TYR . 32.4 mt -136.21 109.26 7.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.905 0.383 . . . . 75.54 111.314 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.87 HG23 ' HG2' ' A' ' 191' ' ' GLU . 38.6 m -109.71 137.04 48.09 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.075 -0.511 . . . . 42.24 110.941 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.614 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 13.7 p90 -153.6 178.02 10.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 61.54 111.039 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 217' ' ' GLU . . . . . 0.457 ' OE2' HD21 ' A' ' 116' ' ' LEU . 10.9 mt-10 -134.07 137.64 44.77 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.926 -0.579 . . . . 70.12 110.541 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.61 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.3 t -120.75 150.97 23.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.131 0.491 . . . . 74.13 111.976 -178.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -136.72 107.58 6.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.612 -0.722 . . . . 75.31 109.953 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.555 HD21 ' CG1' ' A' ' 223' ' ' ILE . 1.0 OUTLIER -70.84 130.57 42.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.433 -0.349 . . . . 70.21 110.913 -179.672 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 25.3 t -107.35 -31.47 2.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.351 -0.386 . . . . 72.21 111.465 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -169.56 160.58 9.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.884 0.373 . . . . 73.1 111.235 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.714 HG23 HG12 ' A' ' 131' ' ' VAL . 44.7 mt -140.56 110.02 3.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.111 -0.495 . . . . 54.24 111.028 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 224' ' ' ASP . . . . . 0.557 ' C ' HG12 ' A' ' 130' ' ' VAL . 2.4 m-20 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 61.13 110.911 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.867 0.365 . . . . 74.41 111.222 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.38 168.28 1.58 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 61.1 111.108 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -144.97 108.41 4.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 61.22 111.152 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 59.6 89.81 0.06 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 54.34 111.138 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.979 HG11 HG21 ' A' ' 136' ' ' THR . 39.2 t -60.07 111.27 3.7 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.185 -0.461 . . . . 71.32 110.965 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.454 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 73.7 Cg_endo -76.48 136.44 17.5 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.654 2.236 . . . . 75.53 112.382 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.528 ' CD ' HD11 ' A' ' 149' ' ' ILE . 2.3 tp-100 -80.66 152.91 28.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.453 . . . . 74.14 110.867 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.7 114.55 1.18 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 72.44 111.173 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -87.75 -38.49 15.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.092 -0.503 . . . . 72.14 110.843 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.595 ' CE2' HD11 ' A' ' 20' ' ' LEU . 1.7 m-90 -112.79 173.69 6.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.955 -0.566 . . . . 63.35 110.708 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.407 ' HB ' ' NE2' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -115.09 150.86 35.3 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.063 -0.517 . . . . 75.05 110.69 179.93 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.476 HG12 ' HD2' ' A' ' 16' ' ' ARG . 39.2 t -56.04 -32.81 34.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.012 0.434 . . . . 72.14 110.668 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -75.62 -24.68 56.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.803 -0.635 . . . . 74.21 110.969 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.407 ' NE2' ' HB ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -82.04 -57.46 3.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.85 0.357 . . . . 70.24 110.803 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.515 ' CB ' HG22 ' A' ' 60' ' ' VAL . 0.9 OUTLIER -49.66 -63.41 1.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.28 -0.418 . . . . 70.03 110.952 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.581 ' CG ' HG21 ' A' ' 60' ' ' VAL . 24.4 mtp180 -53.84 -24.38 15.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 61.45 111.194 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.9 177.46 0.15 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.009 0.433 . . . . 74.14 111.255 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.38 17.08 21.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.826 -0.625 . . . . 62.44 111.151 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -106.83 -24.76 11.96 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.527 -0.306 . . . . 64.51 111.263 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.614 HD22 HD11 ' A' ' 25' ' ' ILE . 6.3 tt -93.98 117.8 67.21 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.517 -0.31 . . . . 72.31 111.051 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.42 ' N ' HD23 ' A' ' 20' ' ' LEU . 31.5 Cg_exo -59.07 127.2 23.35 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.419 2.079 . . . . 73.53 112.076 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -24.13 67.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 74.52 111.162 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HA ' HD12 ' A' ' 26' ' ' ILE . 15.4 ptpt -53.91 -39.73 66.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.343 -0.389 . . . . 63.41 111.523 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -73.74 -55.09 6.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.896 0.379 . . . . 70.33 111.015 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.622 ' O ' HD12 ' A' ' 29' ' ' LEU . 28.7 mt -44.71 -33.65 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.862 -0.608 . . . . 64.23 111.379 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.741 HG12 HD21 ' A' ' 59' ' ' LEU . 6.8 mt -76.02 -39.87 37.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 74.3 110.868 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.2 mtpt -72.15 -26.15 61.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.976 -0.556 . . . . 72.2 111.044 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.486 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 33.8 t80 -69.57 -44.63 70.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.05 0.452 . . . . 75.12 110.742 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.691 HD21 ' HA ' ' A' ' 63' ' ' TYR . 2.9 mt -71.7 -24.39 61.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.705 -0.68 . . . . 65.3 110.992 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -76.38 -24.11 54.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.298 -0.41 . . . . 73.24 110.703 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -103.39 -10.19 18.82 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.253 -0.43 . . . . 73.51 111.125 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.486 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 12.1 m170 -116.58 -11.2 11.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.405 -0.361 . . . . 72.54 111.324 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -121.06 165.27 14.15 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.708 -0.758 . . . . 55.2 112.42 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -92.6 150.88 20.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.606 0.241 . . . . 74.25 110.515 179.739 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.562 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.2 p-10 -48.9 -57.08 7.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.758 0.313 . . . . 61.52 110.941 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.5 m -47.94 -51.97 21.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.018 0.437 . . . . 54.15 110.736 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.493 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 12.5 t80 -52.94 -47.4 68.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.745 -0.662 . . . . 74.22 110.277 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.519 HD22 ' HB3' ' A' ' 43' ' ' LEU . 14.1 mt -65.36 -40.69 93.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.915 -0.584 . . . . 74.42 110.674 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.833 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -49.59 -43.25 46.2 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.227 -0.442 . . . . 54.11 111.063 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -58.01 -29.32 65.2 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.868 -0.606 . . . . 72.13 110.74 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 -112.82 12.02 19.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 55.32 111.102 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 54.44 37.45 27.76 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.866 0.365 . . . . 71.01 110.748 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.679 HD21 HD23 ' A' ' 59' ' ' LEU . 15.3 mt -94.37 -20.95 19.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 74.34 111.895 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.833 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -78.15 155.53 30.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.099 0.476 . . . . 75.25 111.153 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.92 -124.67 6.1 Favored Glycine 0 N--CA 1.451 -0.302 0 CA-C-N 115.638 -0.71 . . . . 64.55 112.43 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.757 ' O ' HG23 ' A' ' 50' ' ' VAL . 8.0 m120 -116.4 119.31 35.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.796 0.331 . . . . 64.41 110.969 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.708 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -45.69 -52.56 2.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.17 -0.468 . . . . 74.03 111.4 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -47.7 -37.09 12.34 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.909 -0.587 . . . . 74.22 110.842 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -85.58 -26.6 26.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.866 -0.606 . . . . 73.21 110.931 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.757 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.5 t -78.59 -26.06 13.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.238 -0.437 . . . . 64.5 111.345 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.33 -25.39 67.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.428 -0.351 . . . . 63.44 111.103 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -95.17 -27.62 15.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 71.31 110.803 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -100.32 33.84 2.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.486 . . . . 74.4 111.012 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -166.76 135.57 2.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 72.21 110.984 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.401 ' H ' ' HB2' ' A' ' 58' ' ' HIS . 14.7 p30 -94.63 177.7 5.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.271 -0.422 . . . . 72.21 110.974 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.558 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -56.62 -57.82 10.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.315 -0.402 . . . . 74.33 110.929 -179.883 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.54 -26.94 64.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.057 -0.519 . . . . 64.04 110.602 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.401 ' HB2' ' H ' ' A' ' 55' ' ' ASN . 0.1 OUTLIER -63.01 -45.69 91.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.023 -0.535 . . . . 75.13 110.793 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.741 HD21 HG12 ' A' ' 26' ' ' ILE . 23.9 mt -73.82 -29.03 61.92 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.714 -0.675 . . . . 75.43 111.202 -179.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.581 HG21 ' CG ' ' A' ' 16' ' ' ARG . 21.1 t -81.08 -43.98 20.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.901 0.382 . . . . 71.32 111.057 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.0 m -59.95 -33.14 71.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.971 -0.559 . . . . 71.43 110.695 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.436 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -84.46 -23.12 30.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 72.52 111.129 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.691 ' HA ' HD21 ' A' ' 29' ' ' LEU . 82.2 t80 -83.78 -23.03 31.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.257 -0.429 . . . . 71.3 110.981 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.502 ' ND2' HG12 ' A' ' 60' ' ' VAL . 42.9 m-20 -81.79 -55.07 4.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 75.23 111.419 -179.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.493 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 4.2 p-80 -61.65 -29.8 70.3 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.153 -0.476 . . . . 71.23 111.296 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.715 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.1 tt -50.2 -40.01 45.88 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.891 0.377 . . . . 64.32 111.194 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -79.03 -38.75 35.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.52 . . . . 74.41 110.695 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.45 -41.15 93.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.941 -0.572 . . . . 75.14 110.768 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.2 p -92.64 -2.61 55.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.936 -0.574 . . . . 60.3 111.462 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.13 38.77 10.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.768 0.318 . . . . 73.22 111.353 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.444 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 45.3 mtt-85 -93.13 43.68 1.13 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.308 -0.406 . . . . 72.14 110.992 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.529 ' HA ' HD21 ' A' ' 66' ' ' LEU . 89.8 m-85 -64.5 178.71 0.7 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 75.43 110.826 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.4 ttmm -68.79 153.03 44.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.28 -0.418 . . . . 74.2 110.923 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.02 -102.47 2.8 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.731 -0.747 . . . . 74.33 112.494 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.46 95.14 1.99 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.83 0.347 . . . . 73.2 110.913 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -110.66 -33.05 6.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 55.05 110.913 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.526 ' O ' HG23 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -101.23 100.43 10.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 53.33 110.924 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.526 HG23 ' O ' ' A' ' 77' ' ' SER . 2.1 pt -158.57 170.78 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 72.42 111.192 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.5 m -65.47 -31.5 72.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.234 -0.439 . . . . 65.43 110.9 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 25.1 mtpt 60.67 111.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 65.43 110.885 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 27.3 t -99.51 -31.29 3.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 74.23 111.105 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.7 m -97.77 164.89 12.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.461 . . . . 72.21 110.919 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -106.54 169.9 8.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 31.3 110.868 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 60.47 31.88 20.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 74.52 110.839 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 19.8 t 69.09 -67.7 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.179 -0.464 . . . . 74.02 111.226 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -129.32 157.87 40.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.957 -0.565 . . . . 72.41 110.909 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 15.2 m-20 -145.86 109.39 4.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.186 -0.461 . . . . 73.11 110.945 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.8 m -110.33 -30.27 2.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.435 . . . . 72.02 111.17 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.71 -31.37 11.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.444 . . . . 63.3 110.921 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.4 tp -91.53 102.69 15.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.437 . . . . 52.31 110.909 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -129.52 139.5 51.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 72.55 110.883 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -109.1 -35.65 6.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 73.05 110.935 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -177.42 37.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 72.12 110.927 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 60.62 88.73 0.12 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 72.14 110.849 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -68.87 116.56 4.52 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.514 2.143 . . . . 71.43 112.307 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -91.01 163.75 14.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.469 . . . . 73.41 110.877 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -118.04 128.45 54.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 71.22 110.902 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.7 m -123.13 147.31 46.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.479 . . . . 73.43 110.887 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -177.66 -39.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 70.35 110.937 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 73.6 m 60.69 159.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.104 -0.498 . . . . 71.14 110.966 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -168.99 74.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 75.3 110.849 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -156.44 173.75 16.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 72.05 110.928 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.0 p -147.31 108.84 4.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 72.43 110.879 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.548 HD23 ' N ' ' A' ' 105' ' ' ASP . 1.1 tt -108.27 152.13 25.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 75.44 110.948 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.548 ' N ' HD23 ' A' ' 104' ' ' LEU . 2.4 m-20 -164.27 -44.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 74.43 111.003 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -122.11 -40.84 2.47 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.09 -0.505 . . . . 72.42 110.954 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 136.57 77.73 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.803 -0.713 . . . . 61.35 112.516 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -69.38 171.05 14.73 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.574 2.183 . . . . 72.24 112.311 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.442 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 32.3 Cg_endo -64.29 -166.19 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.59 2.194 . . . . 61.12 112.253 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.448 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -97.17 30.22 2.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 64.23 111.018 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.442 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 20.3 p90 -157.83 161.93 38.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.299 -0.409 . . . . 74.52 110.84 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 12.2 m -131.46 103.49 6.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 64.13 111.043 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.66 ' HD2' ' HB1' ' A' ' 178' ' ' ALA . 13.8 tttm -109.59 151.49 26.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 74.24 110.705 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.459 ' O ' HD12 ' A' ' 116' ' ' LEU . 2.1 m -143.31 128.47 18.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 61.43 110.874 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.607 ' O ' HG13 ' A' ' 115' ' ' VAL . 9.2 p -78.55 106.34 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.247 -0.433 . . . . 75.35 111.14 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.459 HD12 ' O ' ' A' ' 114' ' ' SER . 6.8 mp -78.94 -78.01 0.16 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.208 -0.451 . . . . 74.23 110.79 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -86.73 108.07 18.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 73.4 110.753 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.44 121.88 12.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.47 . . . . 70.5 111.049 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -100.03 -159.52 28.41 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.74 -0.743 . . . . 71.35 112.139 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.416 ' O ' ' HB2' ' A' ' 121' ' ' LYS . 0.5 OUTLIER -36.11 -48.87 0.63 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.876 0.369 . . . . 73.02 111.572 -179.479 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 120' ' ' ASP . 20.6 mtpt 67.58 36.9 3.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.845 -0.616 . . . . 54.32 110.349 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -153.91 -44.91 0.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.758 -0.656 . . . . 64.05 110.676 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -88.86 98.47 11.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.14 -0.482 . . . . 74.12 110.853 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -110.61 146.19 33.85 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 65.15 110.842 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.617 ' CB ' HG11 ' A' ' 166' ' ' VAL . 51.7 Cg_exo -54.56 125.55 19.35 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.511 2.141 . . . . 63.44 112.453 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.99 152.22 20.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.109 -0.496 . . . . 74.51 110.8 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -55.22 111.59 0.89 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.243 -0.435 . . . . 62.34 110.881 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 99.8 -10.82 60.79 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.742 -0.742 . . . . 60.11 112.708 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -86.92 134.49 33.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.877 0.37 . . . . 70.31 110.953 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.545 HG22 ' N ' ' A' ' 131' ' ' VAL . 7.1 p -70.65 163.38 3.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 73.11 110.989 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.871 HG22 ' O ' ' A' ' 164' ' ' PHE . 15.7 m -155.05 146.55 13.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.241 -0.436 . . . . 74.24 111.017 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.463 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.89 117.91 22.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.735 0.302 . . . . 72.22 110.891 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.47 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 22.3 p -152.48 166.63 31.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 73.43 111.13 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.57 ' HB3' HD13 ' A' ' 149' ' ' ILE . 19.1 m95 -101.92 164.22 11.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.056 -0.52 . . . . 73.23 110.239 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.401 ' CD1' ' OD1' ' A' ' 148' ' ' ASN . 28.6 p90 -160.38 135.16 7.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.072 0.463 . . . . 75.04 111.867 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.979 HG21 HG11 ' A' ' 5' ' ' VAL . 2.9 m -124.74 109.52 13.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.707 -0.679 . . . . 74.41 110.248 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.67 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.55 144.98 17.55 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.613 -0.803 . . . . 51.4 113.414 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.785 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.79 149.51 29.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.863 0.363 . . . . 33.42 110.825 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.81 HD21 HD12 ' A' ' 208' ' ' ILE . 22.7 mt -88.05 -176.37 5.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 72.21 110.845 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -55.87 -43.58 77.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.356 -0.383 . . . . 73.03 110.899 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.07 -16.78 54.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.945 -0.57 . . . . 73.32 111.161 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 107.31 25.86 5.91 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.724 -0.751 . . . . 32.54 112.589 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.5 m -82.06 112.72 19.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.776 0.322 . . . . 73.42 110.867 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.9 t -66.41 126.78 26.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 62.54 111.171 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.689 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 38.7 p90 -114.36 -28.29 7.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.223 -0.444 . . . . 72.2 111.171 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ASP . . . . . 0.421 ' HB2' ' CE1' ' A' ' 145' ' ' PHE . 51.6 m-20 -156.24 111.43 2.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.384 -0.371 . . . . 71.14 110.888 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.633 HG23 HG23 ' A' ' 136' ' ' THR . 61.6 m -142.84 108.88 5.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 25.02 111.096 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.401 ' OD1' ' CD1' ' A' ' 135' ' ' TYR . 20.0 p-10 -102.76 25.6 9.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.428 . . . . 71.03 110.909 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.57 HD13 ' HB3' ' A' ' 134' ' ' TRP . 9.0 mm -82.03 93.44 2.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.342 -0.39 . . . . 71.22 110.83 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.401 ' HB3' ' HB1' ' A' ' 159' ' ' ALA . 0.0 OUTLIER -94.8 -171.97 2.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 74.24 110.849 -179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.81 165.97 2.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 73.0 110.971 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.65 162.2 27.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 64.23 110.924 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.02 -36.98 29.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 54.21 111.092 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -60.01 -33.19 71.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 70.44 110.904 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.6 tttp -86.12 -63.14 1.37 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.009 0.433 . . . . 64.52 110.946 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 29.1 tttt -120.88 149.67 42.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.853 -0.612 . . . . 75.22 110.884 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.87 31.35 3.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 61.33 110.911 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -119.51 44.23 2.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 63.24 110.878 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.401 ' HB1' ' HB3' ' A' ' 150' ' ' GLN . . . -155.43 128.28 8.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 74.53 111.097 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 15.4 mttp -146.4 147.7 31.82 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.901 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.95 158.2 57.51 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.6 2.2 . . . . 73.22 112.301 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 1.6 tt -76.43 123.6 26.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 64.13 110.451 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.632 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.3 122.35 42.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.951 0.405 . . . . 64.35 111.411 -179.851 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.871 ' O ' HG22 ' A' ' 131' ' ' VAL . 6.5 p90 -150.98 143.41 24.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 75.04 110.508 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.63 ' O ' HG12 ' A' ' 168' ' ' VAL . 7.3 mtmt -82.25 141.64 32.79 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.079 0.466 . . . . 74.14 111.226 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.617 HG11 ' CB ' ' A' ' 125' ' ' PRO . 33.4 m -87.57 149.15 4.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.779 -0.646 . . . . 63.52 111.167 -179.468 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.74 24.8 75.43 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.857 -0.687 . . . . 51.52 112.456 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.693 HG22 ' O ' ' A' ' 168' ' ' VAL . 8.4 p -131.69 40.93 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.846 0.355 . . . . 73.35 111.103 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 40.6 34.18 0.68 Allowed Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.996 -0.621 . . . . 51.12 112.942 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.24 -34.26 32.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.053 0.454 . . . . 64.43 110.411 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.8 m -127.34 179.72 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.799 -0.637 . . . . 72.03 110.83 179.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.596 ' CD1' HD13 ' A' ' 192' ' ' ILE . 4.1 pt -58.72 163.84 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.442 -0.344 . . . . 70.04 111.091 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -71.13 -29.21 64.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 65.02 111.197 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.12 -38.09 41.06 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.671 -0.776 . . . . 73.43 112.279 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.734 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.2 t90 -75.22 -32.65 61.21 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.851 0.357 . . . . 75.52 110.996 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -61.94 -43.95 97.79 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 62.53 110.524 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -68.35 -30.82 69.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.903 -0.59 . . . . 73.1 110.751 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.737 ' O ' HG22 ' A' ' 181' ' ' THR . . . -78.0 -61.97 1.83 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.202 -0.454 . . . . 65.23 111.379 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.704 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 6.7 mt -56.07 -31.71 63.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.043 -0.526 . . . . 75.33 111.102 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 35.0 tp -59.49 -32.63 70.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.375 -0.375 . . . . 74.22 111.036 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 181' ' ' THR . . . . . 0.737 HG22 ' O ' ' A' ' 178' ' ' ALA . 12.8 t -92.75 -0.65 57.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.327 -0.397 . . . . 74.13 111.479 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.481 ' HE3' ' C ' ' A' ' 218' ' ' VAL . 0.0 OUTLIER -73.26 152.12 41.13 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.698 0.285 . . . . 62.0 110.871 179.905 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.48 162.61 15.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.296 -0.411 . . . . 74.3 111.107 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 184' ' ' LYS . . . . . 0.635 ' HA ' HD22 ' A' ' 220' ' ' LEU . 1.2 tttm -61.38 119.42 8.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.924 -0.58 . . . . 53.33 111.144 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 76.03 17.79 79.82 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.99 -0.624 . . . . 71.44 113.042 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 186' ' ' GLU . . . . . 0.538 ' CD ' HG23 ' A' ' 115' ' ' VAL . 1.1 tt0 -96.72 145.99 25.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.873 0.368 . . . . 71.41 111.105 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt -117.33 136.88 52.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 62.2 110.01 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -149.77 176.12 10.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.033 0.444 . . . . 53.55 111.808 -179.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.11 136.27 36.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.691 -0.686 . . . . 63.03 109.572 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.71 HD21 ' CE1' ' A' ' 216' ' ' PHE . 1.4 pt? -140.25 140.42 35.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.141 0.496 . . . . 62.32 112.217 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.739 ' HB3' HG23 ' A' ' 215' ' ' THR . 0.0 OUTLIER -117.74 106.02 12.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.609 -0.723 . . . . 53.14 110.034 179.113 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.596 HD13 ' CD1' ' A' ' 172' ' ' ILE . 4.2 mt -96.52 148.36 5.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.999 0.428 . . . . 60.12 111.582 -179.226 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.425 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.6 OUTLIER -81.69 167.51 30.76 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.765 -0.652 . . . . 65.4 110.477 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 194' ' ' PRO . . . . . 0.425 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 18.1 Cg_endo -60.1 -39.84 66.05 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.462 2.108 . . . . 64.13 112.222 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.12 -22.72 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.172 -0.467 . . . . 65.02 111.449 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.448 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 8.9 m0 -118.03 37.01 4.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.687 0.28 . . . . 72.32 111.399 -179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -155.43 -84.56 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.414 -0.357 . . . . 74.01 111.362 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 198' ' ' TYR . . . . . 0.459 ' HD2' HG21 ' A' ' 208' ' ' ILE . 41.4 m-85 -106.0 -27.95 10.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.905 0.384 . . . . 75.21 110.828 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 107.28 178.9 22.55 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.846 -0.692 . . . . 71.33 112.836 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -59.61 -36.22 75.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.826 0.346 . . . . 74.44 110.892 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.6 -50.03 75.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 64.12 110.658 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.3 -153.38 17.25 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.86 -0.686 . . . . 70.05 112.595 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.446 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 2.0 tm0? -152.15 84.26 4.9 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.837 0.351 . . . . 72.51 110.515 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -49.99 -44.43 37.34 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.762 2.308 . . . . 72.31 112.783 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.72 -42.12 71.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 65.24 111.012 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.689 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -96.43 27.37 3.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.031 -0.531 . . . . 61.24 111.29 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt 49.19 30.65 3.15 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.889 0.376 . . . . 61.33 111.057 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.81 HD12 HD21 ' A' ' 139' ' ' LEU . 20.8 mm -94.8 111.75 55.49 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.098 -0.501 . . . . 73.14 111.188 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 209' ' ' PRO . . . . . 0.561 ' HG2' ' HB2' ' A' ' 212' ' ' ALA . 55.9 Cg_endo -69.95 171.04 15.4 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.405 2.07 . . . . 54.14 112.201 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.79 120.95 8.33 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.512 2.141 . . . . 74.24 112.228 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 211' ' ' ASN . . . . . 0.405 ' HA ' ' HG3' ' A' ' 194' ' ' PRO . 49.2 m-80 63.4 70.38 0.53 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.173 -0.467 . . . . 72.24 110.859 -179.722 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 212' ' ' ALA . . . . . 0.561 ' HB2' ' HG2' ' A' ' 209' ' ' PRO . . . -122.42 154.7 37.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.183 -0.462 . . . . 72.42 111.336 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 213' ' ' LYS . . . . . 0.723 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.0 OUTLIER -90.42 149.43 22.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.019 -0.537 . . . . 71.23 110.448 179.646 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.723 HD23 ' O ' ' A' ' 213' ' ' LYS . 9.0 mt -131.5 109.72 10.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.857 0.361 . . . . 75.22 111.313 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.739 HG23 ' HB3' ' A' ' 191' ' ' GLU . 1.4 m -110.11 140.49 44.13 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.057 -0.519 . . . . 74.21 110.779 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.71 ' CE1' HD21 ' A' ' 190' ' ' LEU . 23.2 p90 -155.92 -179.67 8.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.077 0.465 . . . . 75.14 111.374 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 217' ' ' GLU . . . . . 0.417 ' HB3' ' HB2' ' A' ' 7' ' ' GLN . 4.1 mt-10 -132.89 136.61 46.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.72 -0.673 . . . . 73.15 110.256 179.41 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.734 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.8 t -120.99 150.31 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.018 0.437 . . . . 74.14 111.792 -178.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -136.23 108.51 7.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.809 -0.632 . . . . 71.24 110.27 179.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.696 HD21 HG13 ' A' ' 223' ' ' ILE . 2.2 tt -70.05 129.55 39.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.332 -0.394 . . . . 64.1 110.91 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 29.6 t -105.99 -31.7 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.169 -0.469 . . . . 74.25 111.483 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 222' ' ' ASP . . . . . 0.414 ' N ' HD23 ' A' ' 220' ' ' LEU . 5.4 t70 -170.3 161.14 8.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.93 0.395 . . . . 74.31 111.219 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.821 HG23 HG12 ' A' ' 131' ' ' VAL . 38.4 mt -140.85 110.21 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.053 -0.521 . . . . 65.31 111.003 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 224' ' ' ASP . . . . . 0.525 ' C ' HG12 ' A' ' 130' ' ' VAL . 2.7 m-20 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 63.33 110.875 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.814 0.34 . . . . 74.34 111.233 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -133.17 71.4 1.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 64.05 111.111 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -175.58 73.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 73.32 111.088 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -94.97 174.27 7.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 50.11 111.126 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.934 HG11 HG21 ' A' ' 136' ' ' THR . 31.4 t -60.08 110.13 2.58 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.487 . . . . 42.24 110.94 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -82.9 153.64 14.86 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.637 2.224 . . . . 55.52 112.607 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.459 ' NE2' ' O ' ' A' ' 217' ' ' GLU . 1.7 tp-100 -86.38 152.84 22.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 65.02 110.825 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.75 127.03 28.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 54.45 111.134 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -95.58 -31.43 13.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 54.31 110.892 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.455 ' CD1' HD11 ' A' ' 20' ' ' LEU . 3.0 m-90 -114.23 173.62 6.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.046 -0.525 . . . . 74.12 110.732 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 m -115.55 152.3 33.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.044 -0.526 . . . . 53.22 110.708 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.434 HG11 ' CE ' ' A' ' 155' ' ' LYS . 49.1 t -56.24 -34.01 38.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 62.1 110.691 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -73.34 -25.28 60.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.968 -0.56 . . . . 74.44 111.147 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -82.01 -56.55 3.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.821 0.343 . . . . 54.15 110.942 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.687 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.3 mt -49.49 -64.64 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 73.41 111.17 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.502 ' HG3' HG11 ' A' ' 60' ' ' VAL . 34.6 mtp85 -54.11 -25.0 19.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 64.03 111.229 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.96 176.62 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.0 0.429 . . . . 71.53 111.293 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -110.34 17.01 21.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.878 -0.601 . . . . 74.24 111.175 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -112.7 -23.45 10.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.554 -0.294 . . . . 73.32 111.222 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.717 HD22 HD11 ' A' ' 25' ' ' ILE . 10.2 tt -90.07 114.03 59.38 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.509 -0.314 . . . . 71.31 110.99 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -57.92 125.3 18.18 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.493 2.129 . . . . 63.11 112.303 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -24.19 67.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 71.23 111.245 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.499 ' HA ' HD12 ' A' ' 26' ' ' ILE . 29.5 mmtt -52.69 -35.16 54.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.397 . . . . 73.45 111.37 -179.732 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.91 -56.59 4.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.283 -0.417 . . . . 73.15 111.109 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.717 HD11 HD22 ' A' ' 20' ' ' LEU . 40.4 mt -44.79 -32.86 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.896 -0.593 . . . . 72.53 111.474 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.699 HG12 HD21 ' A' ' 59' ' ' LEU . 9.4 mt -75.19 -41.72 44.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.964 0.412 . . . . 45.12 110.907 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -71.55 -25.02 62.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.874 -0.603 . . . . 74.42 111.116 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -70.03 -44.71 68.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.042 0.448 . . . . 62.12 110.761 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.782 HD23 HD12 ' A' ' 66' ' ' LEU . 7.7 mt -72.17 -21.42 61.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.728 -0.669 . . . . 71.21 111.101 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -83.87 -25.78 29.98 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.356 -0.384 . . . . 72.25 111.066 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -100.97 -1.01 35.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.422 -0.354 . . . . 70.52 111.512 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.422 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.9 m-70 -131.95 -6.47 3.53 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.697 0.258 . . . . 61.1 111.697 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.87 164.43 13.07 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.735 -0.745 . . . . 22.0 112.357 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 54.5 p -91.53 147.94 22.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.584 0.23 . . . . 60.33 110.553 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.727 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -48.16 -57.03 6.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.798 0.332 . . . . 54.4 110.991 -179.77 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.9 m -48.67 -50.03 34.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.083 0.468 . . . . 74.51 110.574 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.479 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 36.5 t80 -53.6 -48.76 68.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.695 -0.684 . . . . 52.55 110.404 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.409 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 15.8 mt -65.01 -40.46 94.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.936 -0.575 . . . . 63.23 110.719 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.744 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.17 -47.68 23.89 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.046 0.45 . . . . 75.53 111.098 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -58.09 -26.14 62.2 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.72 -0.673 . . . . 64.4 110.842 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.445 ' O ' ' CG ' ' A' ' 42' ' ' LYS . 52.5 m-70 -112.4 10.57 19.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.265 -0.425 . . . . 74.1 111.239 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.445 ' CG ' ' O ' ' A' ' 41' ' ' HIS . 6.0 ptpt 49.18 35.28 7.08 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.954 0.406 . . . . 63.23 110.995 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.747 HD13 HD13 ' A' ' 29' ' ' LEU . 19.0 mt -93.51 -20.44 20.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.959 -0.564 . . . . 72.23 111.574 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.744 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -79.32 159.26 27.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.026 0.441 . . . . 71.23 111.147 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.56 -120.53 4.97 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 115.775 -0.648 . . . . 60.0 112.482 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.764 ' O ' HG23 ' A' ' 50' ' ' VAL . 46.6 m-80 -116.37 116.12 27.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.826 0.346 . . . . 74.21 110.878 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.662 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.83 -55.57 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.164 -0.471 . . . . 73.23 111.407 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.3 ptpt -46.95 -36.85 8.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.855 -0.611 . . . . 63.41 110.988 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -85.76 -25.47 26.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.939 -0.573 . . . . 72.22 111.067 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.764 HG23 ' O ' ' A' ' 46' ' ' ASN . 28.3 t -83.09 -25.92 7.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.365 -0.379 . . . . 74.01 111.403 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.11 -16.29 63.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.426 -0.352 . . . . 34.4 111.474 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.32 -34.3 12.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.808 0.337 . . . . 34.41 110.895 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.586 HG22 ' HA ' ' A' ' 50' ' ' VAL . 7.4 t -86.95 -30.14 21.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.199 -0.455 . . . . 51.23 111.038 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.13 126.64 40.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 33.1 111.142 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -82.0 177.04 9.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 65.01 110.683 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.574 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -58.84 -58.24 9.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.91 0.386 . . . . 75.44 110.541 179.912 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.17 -27.32 68.99 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.055 -0.52 . . . . 64.04 110.582 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.59 -40.61 95.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.067 -0.515 . . . . 70.41 110.399 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.699 HD21 HG12 ' A' ' 26' ' ' ILE . 20.3 mt -76.59 -31.12 57.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.743 -0.662 . . . . 73.33 110.936 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.687 HG22 ' HB3' ' A' ' 15' ' ' LEU . 21.7 t -77.75 -42.73 29.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.995 0.426 . . . . 73.1 110.68 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 53.6 m -60.51 -35.46 76.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.885 -0.598 . . . . 74.31 110.398 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.448 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -79.54 -22.06 44.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.981 -0.554 . . . . 61.4 110.823 179.456 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.682 ' HA ' HD21 ' A' ' 29' ' ' LEU . 20.4 t80 -83.69 -22.94 31.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.066 -0.516 . . . . 74.43 110.837 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.522 ' ND2' HG12 ' A' ' 60' ' ' VAL . 43.6 m-80 -85.73 -53.74 4.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.17 0.509 . . . . 73.4 110.809 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.479 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 1.6 p-80 -59.97 -24.14 64.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.86 -0.609 . . . . 72.02 110.788 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.782 HD12 HD23 ' A' ' 29' ' ' LEU . 0.6 OUTLIER -44.93 -45.99 10.74 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.016 0.436 . . . . 73.01 110.521 179.641 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -79.28 -38.61 34.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.566 -0.743 . . . . 74.31 109.929 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -64.18 -16.24 61.52 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.739 -0.664 . . . . 53.03 111.246 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.86 -11.99 10.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.349 -0.387 . . . . 71.22 111.269 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 51.91 34.63 13.94 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.832 0.348 . . . . 74.35 110.987 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.455 ' CB ' ' CD1' ' A' ' 37' ' ' PHE . 91.6 mtt180 -98.4 46.45 1.0 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 72.43 110.91 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.599 ' CZ ' HD22 ' A' ' 66' ' ' LEU . 82.1 m-85 -71.15 -178.59 2.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.077 -0.511 . . . . 75.54 110.784 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.8 tttp -73.94 141.33 45.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.303 -0.408 . . . . 72.4 110.824 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.41 ' O ' ' N ' ' A' ' 76' ' ' GLU . . . -153.7 142.83 9.5 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.671 -0.776 . . . . 71.01 112.501 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 69.9 p 52.26 -87.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.607 0.242 . . . . 74.23 111.426 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 74' ' ' GLY . 1.6 mm-40 63.91 -79.98 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.793 0.33 . . . . 71.5 110.976 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.2 m -148.63 -78.09 0.15 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.183 -0.462 . . . . 43.31 110.962 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 28.7 mt 69.31 -67.37 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.088 -0.505 . . . . 62.32 111.203 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.1 t -106.14 137.3 44.31 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.957 -0.565 . . . . 75.1 110.912 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.6 mtmp? -161.58 97.71 1.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 75.34 110.897 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.2 m -107.52 174.27 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.458 . . . . 74.04 111.146 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 36.4 p -104.26 177.02 4.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 74.14 110.946 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -147.95 153.81 39.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 62.33 110.895 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -107.26 31.52 5.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.166 -0.47 . . . . 64.4 110.919 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t 59.95 109.53 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 64.4 111.125 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.4 tttm -161.32 -61.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 72.44 110.892 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -146.47 153.76 40.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 60.43 110.908 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.5 t -88.13 96.55 5.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.177 -0.465 . . . . 62.34 111.076 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.6 mtmt -92.86 89.47 6.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 71.34 110.882 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 17.4 mt -101.54 -31.65 10.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 63.13 110.865 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -118.45 116.87 27.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 73.14 110.91 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -91.91 146.87 23.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.19 -0.459 . . . . 73.51 110.954 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -105.75 -33.01 8.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.445 . . . . 65.11 110.93 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -148.78 148.44 27.75 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 71.15 110.873 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.69 118.33 5.59 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.569 2.179 . . . . 72.11 112.282 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 14.9 tttp -112.11 -35.36 5.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 73.21 110.921 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -156.83 144.0 18.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.11 -0.496 . . . . 60.05 110.898 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.09 -68.89 0.21 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 65.0 110.942 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.95 -38.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.942 -0.572 . . . . 65.25 110.916 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 59.88 99.81 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.13 -0.487 . . . . 70.41 110.927 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -102.57 -29.98 11.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 64.43 111.009 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.7 ' O ' HG23 ' A' ' 103' ' ' THR . 2.0 mt-10 -99.22 166.89 11.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 75.24 110.907 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.7 HG23 ' O ' ' A' ' 102' ' ' GLU . 0.8 OUTLIER -169.16 115.35 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.154 -0.475 . . . . 63.31 110.85 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 tp -60.17 154.83 18.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 72.52 110.937 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -174.86 -40.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 55.3 110.929 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -99.35 -31.45 11.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.071 -0.513 . . . . 60.42 110.914 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.67 64.28 0.85 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.716 -0.754 . . . . 75.23 112.527 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.19 161.09 47.29 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.581 2.187 . . . . 71.14 112.29 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.431 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 41.6 Cg_exo -56.89 -162.24 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.619 2.213 . . . . 63.31 112.292 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -97.67 37.4 1.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.469 . . . . 74.32 110.949 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.431 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 11.9 p90 -167.29 151.68 6.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 71.14 110.864 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 26.0 m -113.74 129.94 56.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 60.11 110.296 179.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.4 ' CG ' ' HB3' ' A' ' 190' ' ' LEU . 0.1 OUTLIER -129.93 144.14 51.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.973 0.416 . . . . 63.13 111.374 -179.546 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.428 ' O ' HD12 ' A' ' 116' ' ' LEU . 0.4 OUTLIER -139.94 120.86 14.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.919 -0.582 . . . . 61.25 110.461 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.604 ' O ' HG13 ' A' ' 115' ' ' VAL . 10.0 p -76.41 106.26 6.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.917 0.389 . . . . 41.32 111.191 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.455 HD11 ' HB3' ' A' ' 189' ' ' ARG . 6.6 mp -75.74 -75.38 0.18 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 70.41 110.87 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -96.97 107.94 20.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.154 -0.476 . . . . 62.23 110.9 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -58.68 126.29 27.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.166 -0.47 . . . . 73.32 110.937 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -86.26 -174.29 49.49 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.654 -0.784 . . . . 35.33 112.224 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -40.46 -40.95 1.32 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.828 0.347 . . . . 73.23 111.544 -179.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.8 tttp 73.4 43.15 0.38 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.461 . . . . 74.53 110.595 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.0 m -157.3 -45.41 0.07 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.899 -0.592 . . . . 73.31 110.55 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.14 97.55 10.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.07 -0.514 . . . . 71.01 110.692 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -111.11 156.12 41.47 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.078 -0.51 . . . . 74.31 110.834 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.776 ' HB2' HG21 ' A' ' 166' ' ' VAL . 46.9 Cg_endo -68.61 125.6 12.96 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.514 2.143 . . . . 71.14 112.342 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.98 152.16 20.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 73.24 110.937 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -58.84 116.1 3.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 72.51 110.9 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 105.05 -21.92 34.61 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.705 -0.759 . . . . 73.42 112.669 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.3 138.99 31.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.845 0.355 . . . . 74.41 110.828 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.701 HG12 ' HG3' ' A' ' 165' ' ' LYS . 24.4 m -69.59 171.95 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 72.12 111.235 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.896 HG22 ' O ' ' A' ' 164' ' ' PHE . 16.4 m -156.87 145.39 11.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.71 -0.677 . . . . 65.54 110.66 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.577 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -127.72 117.61 22.25 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.986 -0.285 . . . . 73.34 110.72 179.705 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.657 ' HB3' HD22 ' A' ' 220' ' ' LEU . 31.3 p -153.67 171.44 18.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.004 0.43 . . . . 70.03 111.15 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.51 ' HE1' HG21 ' A' ' 221' ' ' VAL . 10.0 m95 -107.67 161.85 14.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.8 -0.637 . . . . 75.33 110.107 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.489 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 45.1 p90 -161.74 137.19 7.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.07 0.462 . . . . 75.34 111.917 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.934 HG21 HG11 ' A' ' 5' ' ' VAL . 5.4 m -126.72 112.38 15.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.661 -0.699 . . . . 73.35 110.646 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.612 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.67 142.57 16.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.603 -0.808 . . . . 61.45 112.976 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.605 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -147.58 143.87 28.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.8 0.333 . . . . 71.42 110.762 179.79 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.456 HD23 ' HA ' ' A' ' 139' ' ' LEU . 14.2 mt -83.22 -177.63 6.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 73.44 110.977 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -59.29 -43.22 92.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 72.04 110.906 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.81 -7.78 54.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.045 -0.525 . . . . 74.24 111.327 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' GLY . . . . . 0.442 ' C ' HG22 ' A' ' 138' ' ' THR . . . 92.42 24.12 24.82 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.695 -0.764 . . . . 75.12 112.619 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.41 113.24 25.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.345 . . . . 52.23 110.777 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 137' ' ' GLY . 8.3 p -63.64 130.95 29.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 55.41 111.162 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.432 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 36.2 p90 -108.95 -28.2 9.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.001 -0.545 . . . . 73.12 110.842 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -168.19 122.23 0.92 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.176 -0.465 . . . . 72.11 110.768 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.549 ' OG1' HG23 ' A' ' 136' ' ' THR . 10.4 t -142.87 124.31 14.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.358 -0.383 . . . . 63.12 111.192 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.489 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 25.4 t-20 -91.86 40.85 1.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.082 -0.508 . . . . 60.54 110.804 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.437 ' CD1' ' HB3' ' A' ' 134' ' ' TRP . 6.7 mm -112.68 99.41 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.123 -0.489 . . . . 60.44 110.928 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -96.14 -78.86 0.45 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.306 -0.406 . . . . 74.51 110.979 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 2.8 p -146.53 166.05 27.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.246 -0.433 . . . . 70.53 110.91 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.4 m -74.09 151.63 40.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 74.55 110.863 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.03 -31.25 34.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.149 -0.478 . . . . 53.04 111.166 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -70.23 -34.18 72.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 75.4 111.01 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.434 ' CE ' HG11 ' A' ' 12' ' ' VAL . 0.6 OUTLIER -79.14 -35.79 41.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 70.32 110.889 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.1 mmmt -153.3 155.49 36.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 64.25 110.905 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -98.65 30.4 3.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.2 -0.454 . . . . 63.04 110.924 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -114.72 40.47 2.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 54.12 110.81 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.16 133.25 9.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 65.13 111.097 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -146.38 134.38 10.6 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.255 -0.43 . . . . 73.23 110.837 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.404 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 49.6 Cg_exo -55.37 156.4 17.41 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.446 2.097 . . . . 61.43 112.33 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.535 HD23 ' C ' ' A' ' 162' ' ' LEU . 4.0 tt -74.67 122.96 24.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 74.42 110.429 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.661 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -100.26 121.2 41.09 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.03 0.443 . . . . 74.21 111.48 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.896 ' O ' HG22 ' A' ' 131' ' ' VAL . 7.3 p90 -149.71 140.97 23.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.88 -0.6 . . . . 75.22 110.571 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.701 ' HG3' HG12 ' A' ' 130' ' ' VAL . 72.3 mttt -77.48 136.7 38.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.038 0.447 . . . . 64.44 111.111 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.776 HG21 ' HB2' ' A' ' 125' ' ' PRO . 35.1 m -87.65 149.31 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.822 -0.627 . . . . 54.01 111.084 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.87 22.83 78.34 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.786 -0.721 . . . . 75.53 112.565 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.671 HG23 ' HG2' ' A' ' 170' ' ' LYS . 28.9 m -131.06 42.18 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.88 0.371 . . . . 73.43 111.044 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.25 38.57 6.6 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 121.137 -0.554 . . . . 55.44 113.062 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 170' ' ' LYS . . . . . 0.671 ' HG2' HG23 ' A' ' 168' ' ' VAL . 0.6 OUTLIER -84.34 -47.03 11.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.933 0.397 . . . . 72.0 110.852 179.928 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.9 m -116.91 -179.94 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.943 -0.571 . . . . 62.22 110.913 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.554 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.88 161.44 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.414 -0.357 . . . . 74.42 111.297 -179.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 15.8 ttt85 -69.57 -26.68 64.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.195 -0.457 . . . . 73.13 110.998 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.11 -37.86 36.51 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.772 -0.727 . . . . 64.43 112.029 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.554 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 1.8 t90 -77.46 -32.9 54.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.024 0.44 . . . . 74.33 111.056 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 176' ' ' ASP . . . . . 0.639 ' O ' HD13 ' A' ' 180' ' ' LEU . 1.4 m-20 -65.63 -35.47 80.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.802 -0.635 . . . . 73.43 110.479 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -75.97 -29.17 58.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 71.01 110.634 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.582 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -81.92 -54.44 5.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 64.41 111.125 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.574 HD21 HG21 ' A' ' 218' ' ' VAL . 14.5 mt -62.26 -18.92 62.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.883 -0.599 . . . . 75.54 111.186 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.639 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.8 tp -56.46 -23.91 42.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.344 -0.389 . . . . 65.44 111.452 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 16.5 p -112.94 18.13 18.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.596 -0.275 . . . . 71.15 111.585 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.437 ' HG3' HD22 ' A' ' 179' ' ' LEU . 7.4 mmm -77.06 95.18 4.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.831 0.348 . . . . 63.23 111.123 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.3 168.18 7.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 73.12 111.064 -179.699 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -62.81 113.23 2.92 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.873 -0.603 . . . . 62.31 110.949 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 84.98 0.96 88.99 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 120.854 -0.689 . . . . 54.22 112.91 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.58 137.94 44.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.923 0.392 . . . . 74.44 111.503 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.75 137.41 53.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.976 -0.556 . . . . 71.44 109.766 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -141.83 168.59 19.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.259 0.552 . . . . 70.12 112.132 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 189' ' ' ARG . . . . . 0.455 ' HB3' HD11 ' A' ' 116' ' ' LEU . 1.4 tmt_? -137.78 101.01 4.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.391 -0.822 . . . . 63.15 109.766 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.582 HD13 ' CB ' ' A' ' 178' ' ' ALA . 0.8 OUTLIER -123.66 149.48 45.39 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.067 0.461 . . . . 71.1 112.011 -178.912 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.638 ' HB3' HG23 ' A' ' 215' ' ' THR . 0.2 OUTLIER -119.37 117.1 27.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.605 -0.725 . . . . 71.12 110.247 179.337 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.633 HD12 ' N ' ' A' ' 192' ' ' ILE . 3.3 mp -98.33 137.85 24.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.969 0.414 . . . . 71.03 111.516 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.41 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.4 mt-10 -71.36 167.56 28.94 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.866 -0.607 . . . . 75.4 110.499 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 194' ' ' PRO . . . . . 0.41 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 20.8 Cg_endo -60.94 -41.65 43.21 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.391 2.061 . . . . 65.21 112.261 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -53.11 -26.82 17.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 65.23 111.405 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 196' ' ' TRP . . . . . . . . . . . . . 17.8 m0 -116.1 37.01 3.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.494 -0.321 . . . . 65.23 111.178 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -157.84 -82.3 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.348 -0.387 . . . . 64.24 111.641 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 198' ' ' TYR . . . . . 0.586 ' CE2' HD13 ' A' ' 208' ' ' ILE . 14.2 m-85 -106.25 -32.9 7.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.907 0.384 . . . . 75.23 110.949 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 106.49 172.55 23.02 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.84 -0.695 . . . . 72.45 112.715 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 33.7 mtmt -61.59 -30.41 70.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.832 0.348 . . . . 73.14 110.902 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -56.16 -52.25 65.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 72.33 110.8 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 109.25 158.33 18.26 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.818 -0.706 . . . . 73.11 112.444 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.747 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.9 OUTLIER -104.76 84.84 1.04 Allowed Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 120.771 0.32 . . . . 64.11 110.758 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.01 -20.15 57.43 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.591 2.194 . . . . 52.4 112.412 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -58.56 -41.89 86.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.368 -0.378 . . . . 45.53 110.891 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.5 28.38 8.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.102 -0.499 . . . . 75.33 111.26 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 7.9 tttt 58.43 54.42 5.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.937 0.399 . . . . 70.24 110.95 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.747 HD12 ' HB3' ' A' ' 203' ' ' GLN . 33.9 mt -115.69 111.77 43.41 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 72.45 111.086 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.1 169.26 2.92 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.568 2.179 . . . . 71.11 112.398 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.27 128.01 12.49 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.636 2.224 . . . . 74.42 112.24 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 65.81 74.22 0.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.31 -0.404 . . . . 51.22 110.758 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.57 153.5 43.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.434 . . . . 74.01 111.365 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.12 139.16 30.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.011 -0.54 . . . . 75.22 110.367 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.447 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 5.8 mt -120.45 109.48 15.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.922 0.391 . . . . 73.1 111.441 -179.54 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.638 HG23 ' HB3' ' A' ' 191' ' ' GLU . 2.6 m -107.48 141.1 39.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.018 -0.537 . . . . 75.32 110.662 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.612 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 5.8 p90 -159.64 -177.7 6.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 73.43 111.177 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 217' ' ' GLU . . . . . 0.459 ' O ' ' NE2' ' A' ' 7' ' ' GLN . 17.9 mt-10 -138.71 141.86 38.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.899 -0.591 . . . . 72.33 110.552 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.574 HG21 HD21 ' A' ' 179' ' ' LEU . 23.5 t -121.55 152.43 25.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 70.42 112.01 -178.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -135.5 106.0 6.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.707 -0.679 . . . . 75.02 110.356 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.657 HD22 ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.67 126.79 30.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.362 -0.381 . . . . 73.43 110.658 -179.774 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.51 HG21 ' HE1' ' A' ' 134' ' ' TRP . 21.2 t -108.06 -30.25 2.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.263 -0.426 . . . . 71.13 111.654 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -169.96 160.05 8.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.915 0.388 . . . . 63.53 111.183 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.647 HG23 HG12 ' A' ' 131' ' ' VAL . 3.5 mp -141.85 111.27 2.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.971 -0.559 . . . . 61.21 110.955 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.327 -0.397 . . . . 64.44 110.958 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.629 ' HB3' HG21 ' A' ' 75' ' ' THR . 2.5 mpt? . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.849 0.357 . . . . 53.45 111.207 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.56 156.24 25.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.179 -0.464 . . . . 62.21 111.028 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.597 ' O ' ' HB2' ' A' ' 4' ' ' ALA . . . -60.84 -168.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.183 -0.462 . . . . 43.2 111.113 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.597 ' HB2' ' O ' ' A' ' 3' ' ' ALA . . . 161.73 87.21 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.135 -0.484 . . . . 73.35 110.948 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 1.021 HG11 HG21 ' A' ' 136' ' ' THR . 43.8 t -87.17 111.1 38.6 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.595 -0.275 . . . . 51.33 110.966 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.434 ' HG3' ' CG ' ' A' ' 32' ' ' HIS . 72.4 Cg_endo -77.62 136.99 15.89 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.638 2.226 . . . . 74.44 112.435 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.496 ' NE2' ' HB2' ' A' ' 134' ' ' TRP . 9.3 mm100 -80.25 155.52 27.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 71.14 110.902 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.09 112.81 0.78 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.137 -0.483 . . . . 64.13 111.221 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.449 ' HB2' ' HE2' ' A' ' 187' ' ' LYS . . . -90.44 -14.78 32.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 71.43 111.414 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.595 ' CE2' HD11 ' A' ' 20' ' ' LEU . 1.3 m-90 -137.98 173.79 11.26 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.967 0.413 . . . . 74.3 110.814 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.2 m -115.43 149.83 37.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.988 -0.551 . . . . 63.43 110.713 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.678 HG11 ' HE2' ' A' ' 154' ' ' LYS . 21.9 t -56.09 -31.33 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.926 0.393 . . . . 73.12 110.712 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -76.02 -25.96 56.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.871 -0.604 . . . . 70.11 111.004 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -82.11 -57.92 3.18 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.834 0.349 . . . . 54.12 110.813 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.644 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.3 mt -49.57 -63.09 1.21 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.222 -0.445 . . . . 73.2 110.948 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.591 ' HD2' HG12 ' A' ' 12' ' ' VAL . 25.4 mtt180 -53.99 -23.79 14.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.071 -0.513 . . . . 74.51 111.243 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.18 176.76 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.964 0.412 . . . . 62.43 111.121 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -110.34 16.8 21.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.95 -0.568 . . . . 74.31 111.158 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.41 -26.09 12.09 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.512 -0.313 . . . . 71.31 111.144 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.699 HD22 HD11 ' A' ' 25' ' ' ILE . 6.3 tt -91.97 111.55 50.45 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.39 -0.368 . . . . 64.53 111.016 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.406 ' O ' HD23 ' A' ' 20' ' ' LEU . 48.2 Cg_exo -55.88 130.01 38.04 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.378 2.052 . . . . 51.14 112.184 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.42 ' O ' HD12 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -62.31 -24.09 67.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 75.23 111.127 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.5 mttt -49.78 -43.19 48.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.31 -0.404 . . . . 71.2 111.588 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -73.86 -54.79 7.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.936 0.398 . . . . 75.12 111.07 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.699 HD11 HD22 ' A' ' 20' ' ' LEU . 25.7 mt -45.36 -33.86 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.846 -0.615 . . . . 71.43 111.443 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.694 HG12 HD21 ' A' ' 59' ' ' LEU . 6.7 mt -76.79 -39.85 31.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.284 -0.416 . . . . 73.24 110.995 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.1 mttt -72.86 -25.61 61.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.036 -0.529 . . . . 61.15 111.009 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -69.74 -45.78 67.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.121 0.486 . . . . 74.14 110.719 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.723 HD21 ' HA ' ' A' ' 63' ' ' TYR . 2.6 mt -70.17 -25.58 63.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.608 -0.724 . . . . 62.14 111.115 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -74.38 -26.74 60.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.355 -0.384 . . . . 64.2 110.893 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.416 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 8.6 pt-20 -90.81 -39.05 12.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.346 -0.388 . . . . 73.23 110.706 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.434 ' CG ' ' HG3' ' A' ' 6' ' ' PRO . 35.8 m170 -98.54 16.63 21.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 64.1 110.964 179.674 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.61 153.32 23.02 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.829 -0.7 . . . . 62.42 112.571 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.57 154.47 19.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.651 0.263 . . . . 53.33 110.515 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.67 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.1 OUTLIER -49.14 -56.97 7.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.76 0.315 . . . . 74.42 111.1 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -48.18 -50.23 29.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.033 0.444 . . . . 54.42 110.896 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.545 ' CZ ' HD12 ' A' ' 66' ' ' LEU . 13.4 t80 -54.04 -47.73 71.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.795 -0.639 . . . . 72.11 110.493 179.593 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.441 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 13.3 mt -66.02 -41.39 91.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.062 -0.517 . . . . 65.01 110.777 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.827 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -48.07 -42.04 27.67 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.076 0.465 . . . . 73.4 110.827 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -49.55 -50.11 43.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.621 -0.718 . . . . 74.4 110.926 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -101.49 15.3 29.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.076 -0.511 . . . . 63.21 111.291 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 36.1 mttt 54.98 39.92 31.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.884 0.373 . . . . 73.53 111.05 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 43' ' ' LEU . 17.0 mt -89.53 -22.18 22.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 72.41 111.487 -179.67 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.827 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.42 156.01 28.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.106 0.479 . . . . 74.23 111.171 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.72 -120.98 4.87 Favored Glycine 0 N--CA 1.451 -0.301 0 CA-C-N 115.641 -0.709 . . . . 74.12 112.379 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.897 ' O ' HG23 ' A' ' 50' ' ' VAL . 5.2 m120 -116.39 115.2 25.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.771 0.32 . . . . 53.42 110.948 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.531 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -45.18 -58.37 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.186 -0.461 . . . . 62.42 111.397 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 mmtt -45.57 -36.96 5.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.782 -0.644 . . . . 74.35 111.049 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -85.77 -26.54 25.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.939 -0.573 . . . . 71.53 110.993 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 46' ' ' ASN . 19.3 t -80.83 -26.03 10.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 71.12 111.417 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.64 -15.7 63.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.364 -0.38 . . . . 62.31 111.394 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.3 mtpt -95.17 -35.16 11.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.411 -0.359 . . . . 63.44 110.931 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 m -86.03 -22.42 27.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.173 -0.467 . . . . 61.44 111.318 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -107.95 136.76 47.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.467 -0.333 . . . . 35.33 111.19 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -93.27 -178.02 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 65.3 110.768 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.546 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -59.71 -58.1 10.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.825 0.345 . . . . 72.31 110.981 -179.758 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.32 -27.3 65.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.119 -0.491 . . . . 72.35 110.67 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -45.48 93.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.007 -0.542 . . . . 71.14 110.702 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.694 HD21 HG12 ' A' ' 26' ' ' ILE . 23.6 mt -73.31 -30.49 63.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.625 -0.716 . . . . 70.55 111.415 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.644 HG22 ' HB3' ' A' ' 15' ' ' LEU . 16.0 t -80.51 -43.67 21.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.989 0.424 . . . . 71.3 110.853 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.1 m -58.44 -35.87 72.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.881 -0.6 . . . . 71.43 110.583 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.71 -21.84 34.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.084 -0.507 . . . . 71.24 111.031 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.723 ' HA ' HD21 ' A' ' 29' ' ' LEU . 49.3 t80 -83.28 -22.96 32.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.298 -0.41 . . . . 73.22 111.162 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.476 ' ND2' HG12 ' A' ' 60' ' ' VAL . 19.8 m-80 -83.07 -54.03 5.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.885 0.374 . . . . 74.13 111.43 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.433 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 4.4 p-80 -61.16 -34.08 74.45 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.495 . . . . 63.03 111.283 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.661 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.2 tt -46.42 -40.47 12.24 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.898 0.38 . . . . 73.11 111.201 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -78.98 -36.09 41.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.009 -0.541 . . . . 74.42 110.691 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.536 ' HG2' HG23 ' A' ' 69' ' ' THR . 2.2 pt-20 -67.25 -39.85 86.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.058 -0.519 . . . . 72.24 110.873 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.536 HG23 ' HG2' ' A' ' 68' ' ' GLU . 71.5 p -94.87 -3.1 49.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.025 -0.534 . . . . 33.34 111.434 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 48.96 39.66 15.1 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.757 0.313 . . . . 61.45 111.38 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -93.52 43.66 1.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.384 -0.371 . . . . 73.34 111.034 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.447 ' HA ' HD21 ' A' ' 66' ' ' LEU . 88.5 m-85 -66.26 177.09 1.54 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.317 -0.401 . . . . 61.4 110.82 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.2 tttt -66.57 153.06 43.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.262 -0.426 . . . . 74.53 110.985 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' A' ' 76' ' ' GLU . . . -133.32 74.98 0.43 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.77 -0.728 . . . . 74.24 112.529 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.629 HG21 ' HB3' ' A' ' 1' ' ' MET . 4.4 p 51.59 -87.77 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.612 0.244 . . . . 71.15 111.367 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.53 ' H ' ' HG1' ' A' ' 75' ' ' THR . 3.7 mt-10 63.39 143.23 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.82 0.343 . . . . 72.05 110.884 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.48 ' O ' HG23 ' A' ' 78' ' ' ILE . 1.6 t -66.58 113.14 4.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 45.44 110.897 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.743 HD12 ' N ' ' A' ' 79' ' ' SER . 2.5 pp -157.49 -44.98 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 54.22 111.208 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.743 ' N ' HD12 ' A' ' 78' ' ' ILE . 92.4 p -105.03 127.62 52.96 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.029 -0.532 . . . . 75.41 110.911 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.3 tttp -134.82 92.47 2.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 74.3 110.919 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.4 t -99.94 99.14 7.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 72.53 111.101 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 50.7 p -161.63 -44.66 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 71.42 110.886 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 66.5 -75.97 0.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.238 -0.437 . . . . 52.24 110.937 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 62.76 147.73 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.018 -0.537 . . . . 63.55 110.933 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.486 HG12 ' N ' ' A' ' 86' ' ' LYS . 21.3 t -109.31 159.0 9.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 61.11 111.164 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.492 ' O ' HG22 ' A' ' 88' ' ' VAL . 1.6 tttp -59.31 -172.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.272 -0.422 . . . . 64.32 110.95 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -61.18 95.29 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 70.43 110.919 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.492 HG22 ' O ' ' A' ' 86' ' ' LYS . 30.0 m -150.62 164.92 2.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 75.32 111.094 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.87 -36.94 11.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 74.35 110.865 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 12.8 mt 58.61 106.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.481 . . . . 71.34 110.956 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -97.23 77.59 2.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 65.31 110.842 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -175.42 160.72 2.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 73.22 110.869 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -94.44 120.65 34.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 71.4 110.876 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.8 mtpm? -112.27 150.15 42.09 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 73.33 110.885 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.1 177.85 5.38 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.533 2.155 . . . . 74.14 112.329 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.42 106.46 16.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.245 -0.434 . . . . 42.41 110.875 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -101.05 151.52 21.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 74.23 110.891 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.542 HG23 ' O ' ' A' ' 98' ' ' THR . 7.2 t -175.73 87.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 71.23 110.911 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 mmtm 62.5 -80.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.124 -0.489 . . . . 75.12 111.026 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.5 m -84.69 164.69 18.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.243 -0.435 . . . . 60.12 110.926 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -96.24 76.58 3.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.437 . . . . 74.21 110.951 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 60.08 109.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 71.25 110.891 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 10.0 p -123.93 101.08 7.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 73.33 110.889 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.465 HD12 HG23 ' A' ' 112' ' ' THR . 10.0 mt 60.4 93.13 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.465 . . . . 73.0 110.926 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -106.93 -29.76 9.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 73.33 110.919 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -58.84 -31.13 68.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 60.22 110.951 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 112.75 95.04 2.18 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.735 -0.745 . . . . 75.21 112.523 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -68.1 157.7 60.68 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.502 2.134 . . . . 73.34 112.304 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -49.36 -71.84 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.564 2.176 . . . . 61.13 112.496 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.444 ' HB3' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -163.86 23.68 0.07 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.461 . . . . 70.02 110.687 179.746 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -166.53 150.52 7.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 74.14 110.858 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.465 HG23 HD12 ' A' ' 104' ' ' LEU . 77.0 m -112.23 133.02 54.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.126 -0.488 . . . . 75.32 110.346 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.402 ' CE ' HG22 ' A' ' 115' ' ' VAL . 1.0 OUTLIER -130.88 148.32 52.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.953 0.406 . . . . 64.11 111.33 -179.607 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -149.6 121.75 8.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.934 -0.576 . . . . 53.21 110.742 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.402 HG22 ' CE ' ' A' ' 113' ' ' LYS . 21.5 t -78.86 110.24 14.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.326 -0.397 . . . . 75.22 111.224 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.526 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -81.69 -46.62 14.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 64.03 110.926 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -124.32 108.12 11.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.438 . . . . 74.34 111.054 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.6 ttpm? -59.57 141.89 53.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 74.41 110.865 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.504 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -112.86 -156.11 12.35 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.738 -0.744 . . . . 71.21 112.605 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -36.05 -51.72 0.74 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.96 0.409 . . . . 64.52 111.527 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 69.03 33.82 3.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.926 -0.579 . . . . 63.1 110.307 -179.692 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 54.8 m -152.4 -44.61 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.76 -0.655 . . . . 60.43 110.698 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -88.94 91.13 8.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.481 . . . . 62.13 110.732 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -99.5 152.72 37.9 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 74.15 110.826 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.57 ' HB2' HG21 ' A' ' 166' ' ' VAL . 61.2 Cg_endo -72.96 125.5 10.46 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.551 2.167 . . . . 72.24 112.495 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.4 mmtm -96.36 154.13 17.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.982 -0.554 . . . . 63.23 110.865 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.0 tptm -56.75 119.67 6.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.24 -0.437 . . . . 52.44 110.795 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 100.24 -22.72 38.81 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.626 -0.797 . . . . 72.44 112.366 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.708 ' O ' HG22 ' A' ' 166' ' ' VAL . 5.0 m-20 -81.54 137.63 35.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.745 0.307 . . . . 70.24 110.69 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.57 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 15.6 m -75.09 175.41 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.198 0.523 . . . . 65.43 111.767 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.685 HG12 HG23 ' A' ' 223' ' ' ILE . 22.3 m -157.75 147.0 9.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.342 -0.845 . . . . 74.13 110.557 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.638 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -125.21 117.27 23.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.701 0.286 . . . . 74.41 110.633 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.456 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 32.1 p -154.2 167.25 30.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.87 0.367 . . . . 74.33 111.156 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.602 ' HB3' HD11 ' A' ' 149' ' ' ILE . 62.6 m95 -99.66 160.6 14.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.972 -0.558 . . . . 64.25 110.065 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 33.4 p90 -158.76 135.18 9.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.065 0.459 . . . . 75.23 111.584 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' THR . . . . . 1.021 HG21 HG11 ' A' ' 5' ' ' VAL . 54.3 m -126.74 111.59 14.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.658 -0.701 . . . . 64.24 110.417 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.577 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.78 142.9 16.35 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.604 -0.808 . . . . 75.31 113.07 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.69 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.1 OUTLIER -149.34 138.95 21.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.761 0.315 . . . . 73.1 110.799 179.764 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.831 HD11 HG12 ' A' ' 208' ' ' ILE . 32.6 mt -72.81 -178.14 2.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.296 -0.411 . . . . 63.15 110.64 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -58.89 -42.59 89.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.987 0.422 . . . . 73.34 110.796 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.27 -7.67 55.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.942 -0.572 . . . . 72.44 111.368 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' GLY . . . . . 0.423 ' HA2' ' HB2' ' A' ' 3' ' ' ALA . . . 94.7 25.77 14.61 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.648 -0.787 . . . . 63.02 112.582 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.27 108.38 18.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.8 0.333 . . . . 73.44 110.837 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 144' ' ' VAL . 11.2 p -66.31 124.01 20.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.18 -0.463 . . . . 75.53 111.116 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.434 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 44.8 p90 -110.08 -21.28 12.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.155 -0.475 . . . . 71.4 111.095 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -157.02 127.94 6.73 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.857 0.361 . . . . 74.22 110.997 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 75.1 m -142.79 105.28 4.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 54.1 110.862 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -76.07 -6.52 51.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 73.42 111.323 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.716 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.4 mp -95.78 114.76 33.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.827 0.346 . . . . 63.42 111.0 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -116.65 -73.94 0.63 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 71.41 110.908 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 61.4 p -113.15 165.96 11.89 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 60.54 110.909 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.3 m -95.12 168.53 10.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 51.23 110.895 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.04 -31.2 34.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.455 . . . . 63.42 111.093 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' LYS . . . . . 0.678 ' HE2' HG11 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -60.05 -31.73 70.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 54.14 110.949 -179.965 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -78.36 -39.18 40.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 74.14 110.928 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 4.5 tttp -178.33 -177.63 0.58 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.097 -0.501 . . . . 53.13 110.919 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -98.97 34.73 2.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 73.11 110.872 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 45.4 m-20 -100.59 36.75 1.84 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 73.12 110.933 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -155.6 126.46 6.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 60.53 111.131 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.2 tttt -146.64 145.41 23.09 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 54.43 110.676 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.65 158.02 58.01 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.355 2.037 . . . . 73.33 112.239 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -80.04 127.87 32.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.126 -0.488 . . . . 72.12 110.845 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.638 ' HB3' ' CD2' ' A' ' 132' ' ' HIS . 0.8 OUTLIER -105.73 126.83 52.62 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.272 -0.422 . . . . 74.11 111.047 179.801 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.701 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 20.8 p90 -151.35 141.45 22.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 72.33 110.951 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.605 ' CB ' HG21 ' A' ' 168' ' ' VAL . 2.4 mtpt -69.62 130.81 43.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.305 -0.407 . . . . 71.33 110.909 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.708 HG22 ' O ' ' A' ' 129' ' ' ASP . 33.3 m -87.77 149.32 4.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 63.33 111.057 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 69.04 24.22 75.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.729 -0.748 . . . . 74.21 112.577 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.605 HG21 ' CB ' ' A' ' 165' ' ' LYS . 15.4 m -134.09 46.43 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.915 0.388 . . . . 73.1 111.125 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.29 36.24 2.92 Favored Glycine 0 C--N 1.331 0.302 0 CA-C-N 116.101 -0.499 . . . . 50.4 113.295 179.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 170' ' ' LYS . . . . . 0.513 ' HG2' HG23 ' A' ' 168' ' ' VAL . 0.3 OUTLIER -82.43 -45.72 14.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.858 0.361 . . . . 74.42 111.089 -179.867 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -119.26 -179.64 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.087 -0.506 . . . . 74.4 110.994 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.557 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -58.35 159.33 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.394 -0.367 . . . . 72.1 111.136 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 7.4 ttt85 -68.04 -27.23 66.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.254 -0.43 . . . . 73.13 111.191 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.3 -36.34 39.91 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.663 -0.78 . . . . 51.02 112.169 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.765 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.2 t90 -78.28 -33.62 49.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.909 0.385 . . . . 72.15 111.109 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -64.42 -38.26 90.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.088 -0.506 . . . . 55.2 110.489 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -73.5 -30.62 63.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.901 -0.59 . . . . 73.02 110.619 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.605 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -79.74 -55.96 4.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.496 . . . . 65.51 111.106 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.701 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 5.3 mt -59.69 -28.78 67.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.933 -0.576 . . . . 74.54 110.809 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.4 mt -60.42 -32.02 70.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.425 . . . . 64.03 110.789 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 63.9 p -92.41 2.45 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 65.03 111.407 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.402 ' HB3' HD12 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -76.24 150.04 37.09 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.741 0.305 . . . . 65.24 110.769 179.916 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.4 165.38 13.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 63.24 111.206 -179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 184' ' ' LYS . . . . . 0.69 ' HA ' HD22 ' A' ' 220' ' ' LEU . 1.0 OUTLIER -60.49 117.62 5.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.951 -0.568 . . . . 72.52 110.8 179.807 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.53 66.41 2.25 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.675 -0.774 . . . . 71.24 112.319 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 186' ' ' GLU . . . . . 0.504 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.8 tt0 -144.51 145.81 32.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.602 0.239 . . . . 73.12 110.389 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 187' ' ' LYS . . . . . 0.449 ' HE2' ' HB2' ' A' ' 9' ' ' ALA . 0.5 OUTLIER -117.55 134.72 54.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.688 0.28 . . . . 74.12 110.332 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.29 168.0 20.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.113 0.482 . . . . 61.23 111.648 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.56 104.43 5.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.64 -0.709 . . . . 70.43 109.882 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.687 HD12 HD11 ' A' ' 192' ' ' ILE . 0.4 OUTLIER -126.52 147.18 49.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.081 0.467 . . . . 45.13 111.832 -179.069 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.843 ' HG3' HG23 ' A' ' 215' ' ' THR . 1.3 mp0 -117.07 125.17 50.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.689 -0.687 . . . . 72.43 110.438 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.687 HD11 HD12 ' A' ' 190' ' ' LEU . 2.4 mm -94.32 152.15 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.881 0.372 . . . . 74.32 111.221 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -87.06 159.11 51.95 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.052 -0.522 . . . . 70.12 110.657 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.37 -44.36 38.74 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.567 2.178 . . . . 55.12 112.228 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -56.34 -39.65 73.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.268 -0.424 . . . . 74.5 111.194 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.444 ' CD2' ' HB3' ' A' ' 110' ' ' LYS . 9.9 m0 -97.37 36.95 1.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.324 -0.398 . . . . 70.11 110.99 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -164.64 -77.52 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.025 -0.534 . . . . 53.33 110.705 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 198' ' ' TYR . . . . . 0.785 ' CE2' HD11 ' A' ' 214' ' ' LEU . 22.3 m-85 -102.85 -71.22 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 71.14 110.571 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 135.32 175.87 14.06 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.839 -0.696 . . . . 62.52 112.714 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 19.8 mtpt -58.34 -32.38 68.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.879 0.371 . . . . 74.44 110.884 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 11.1 mttm -59.83 -52.95 63.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 62.12 110.729 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 103.58 176.11 26.04 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.822 -0.704 . . . . 45.2 112.499 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.431 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.4 OUTLIER -117.3 81.75 13.86 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.822 0.344 . . . . 75.11 110.791 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.12 -25.26 44.74 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.669 2.246 . . . . 64.45 112.46 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.25 -42.19 94.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.917 0.389 . . . . 64.12 111.04 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -103.82 29.81 5.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.114 -0.494 . . . . 73.25 111.212 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 39.8 mttt 56.09 28.03 12.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.258 -0.428 . . . . 73.2 111.075 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.831 HG12 HD11 ' A' ' 139' ' ' LEU . 40.0 mt -91.38 111.67 50.15 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 73.43 110.992 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -74.0 173.92 13.25 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.491 2.127 . . . . 72.32 112.474 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -51.04 137.91 44.2 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.674 2.249 . . . . 72.24 112.255 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 5.9 p30 42.11 88.81 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.151 -0.477 . . . . 71.25 111.395 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.47 116.27 21.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.319 -0.4 . . . . 55.54 111.398 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 1.6 tptm -65.66 126.58 28.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 64.2 110.378 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.785 HD11 ' CE2' ' A' ' 198' ' ' TYR . 19.1 mt -104.47 109.52 21.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.342 -0.39 . . . . 72.15 111.44 -179.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.843 HG23 ' HG3' ' A' ' 191' ' ' GLU . 52.4 m -102.45 137.31 40.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 70.24 110.563 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.577 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 5.5 p90 -154.94 175.26 14.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.027 0.442 . . . . 75.25 111.331 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -133.01 136.77 46.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.645 . . . . 73.43 110.523 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.765 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.1 t -123.63 150.56 27.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.072 0.463 . . . . 64.32 111.891 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -136.81 111.07 8.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.744 -0.662 . . . . 74.4 110.225 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.74 HD21 HG13 ' A' ' 223' ' ' ILE . 1.9 tt -69.93 129.28 39.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.831 0.348 . . . . 52.54 111.004 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 21.6 t -108.7 -29.32 2.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 64.54 111.421 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 222' ' ' ASP . . . . . 0.426 ' N ' HD23 ' A' ' 220' ' ' LEU . 5.7 t70 -170.66 161.34 7.49 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.91 0.386 . . . . 53.11 111.018 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.74 HG13 HD21 ' A' ' 220' ' ' LEU . 46.6 mt -139.79 110.43 4.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 74.15 111.051 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 224' ' ' ASP . . . . . 0.405 ' C ' HG22 ' A' ' 130' ' ' VAL . 27.0 t70 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 74.54 110.952 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 ttp . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.83 0.348 . . . . 73.3 111.228 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.9 143.29 49.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 72.5 111.102 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.98 127.44 11.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.228 -0.442 . . . . 70.22 111.136 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.485 ' HB2' ' HB ' ' A' ' 215' ' ' THR . . . -88.22 174.45 8.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 54.23 111.077 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.94 HG11 HG21 ' A' ' 136' ' ' THR . 43.0 t -60.09 110.37 2.78 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 54.24 111.055 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.43 ' HD2' ' CE2' ' A' ' 72' ' ' PHE . 95.1 Cg_endo -78.72 143.84 19.05 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.667 2.244 . . . . 75.54 112.408 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -81.67 151.34 27.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 64.35 110.774 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.57 113.99 0.95 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 74.23 111.182 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -88.07 -16.34 33.84 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.14 -0.482 . . . . 55.22 111.351 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.414 ' CH2' ' HB3' ' A' ' 24' ' ' ASP . 3.9 m-90 -136.34 173.63 11.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.836 0.35 . . . . 63.31 110.719 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.1 m -115.82 150.33 37.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.069 -0.514 . . . . 72.52 110.617 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.626 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.9 t -56.3 -32.06 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.958 0.409 . . . . 71.14 110.772 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -77.01 -24.66 52.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.926 -0.579 . . . . 60.22 111.156 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.421 ' O ' ' HB2' ' A' ' 17' ' ' SER . 3.4 tt0 -82.12 -57.25 3.48 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.851 0.358 . . . . 74.34 110.911 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.631 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.2 mt -51.3 -60.31 3.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.253 -0.43 . . . . 74.24 111.012 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.626 ' HD2' HG12 ' A' ' 12' ' ' VAL . 21.7 mtt180 -57.51 -25.43 59.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.031 -0.531 . . . . 72.53 111.33 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.421 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -59.02 173.06 0.49 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.847 0.356 . . . . 72.32 110.983 -179.867 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -99.78 16.18 24.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.095 -0.502 . . . . 74.12 111.207 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -112.31 -30.35 7.21 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.421 -0.354 . . . . 73.34 110.805 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.924 HD12 HD11 ' A' ' 25' ' ' ILE . 2.4 tm? -75.26 114.27 33.78 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 44.33 110.673 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.681 ' HD2' HD22 ' A' ' 20' ' ' LEU . 34.4 Cg_endo -64.91 123.3 11.42 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.389 2.059 . . . . 71.1 112.488 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.404 ' HB2' ' CD1' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -62.75 -26.52 68.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.04 -0.527 . . . . 75.23 111.254 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.483 ' HA ' HD12 ' A' ' 26' ' ' ILE . 4.2 ttmt -53.54 -37.02 62.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.877 0.37 . . . . 73.42 111.174 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.414 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 0.1 OUTLIER -74.41 -56.1 5.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 72.2 110.845 179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.924 HD11 HD12 ' A' ' 20' ' ' LEU . 42.5 mt -44.89 -32.09 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.83 -0.623 . . . . 72.54 111.44 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.642 ' HB ' HG23 ' A' ' 47' ' ' ILE . 7.6 mt -76.66 -40.68 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 60.03 111.038 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -71.42 -24.91 62.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.893 -0.594 . . . . 73.14 111.21 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -72.36 -45.5 59.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.949 0.404 . . . . 75.42 110.886 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.785 HD21 ' HA ' ' A' ' 63' ' ' TYR . 3.6 mt -68.41 -25.09 64.86 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.859 -0.609 . . . . 73.24 111.053 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -80.95 -24.44 38.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.31 -0.404 . . . . 70.5 111.177 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.42 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -101.26 -7.35 23.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.469 -0.332 . . . . 74.13 111.503 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.42 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.9 m-70 -125.78 -3.13 7.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.7 -0.227 . . . . 73.45 111.606 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.43 161.37 19.91 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.707 -0.758 . . . . 54.33 112.418 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -89.68 149.45 22.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.588 0.233 . . . . 62.42 110.61 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.657 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -49.1 -57.0 7.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.801 0.334 . . . . 73.21 111.075 -179.798 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 14.5 m -47.24 -51.61 18.29 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.217 -0.447 . . . . 71.43 110.852 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.49 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 12.8 t80 -55.19 -44.3 75.19 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.857 -0.61 . . . . 54.53 110.323 179.56 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.583 HD12 ' HA ' ' A' ' 35' ' ' ASP . 13.4 mt -65.38 -42.4 92.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.015 -0.539 . . . . 73.43 110.665 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.819 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -46.48 -45.35 18.28 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.223 -0.444 . . . . 73.11 111.171 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.28 -25.74 64.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.857 -0.611 . . . . 71.04 110.859 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 67.0 m-70 -112.69 8.49 19.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.253 -0.43 . . . . 74.33 111.166 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt 54.38 33.7 19.14 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.804 0.335 . . . . 74.11 110.905 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.735 HD13 HD13 ' A' ' 29' ' ' LEU . 61.8 mt -92.39 -24.9 18.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 51.54 111.758 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.819 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -73.79 156.66 37.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.092 0.472 . . . . 72.14 111.185 -179.568 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.4 -122.75 5.7 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.671 -0.695 . . . . 61.43 112.378 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.789 ' O ' HG23 ' A' ' 50' ' ' VAL . 4.1 m120 -116.31 119.48 35.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.787 0.327 . . . . 64.03 110.93 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.642 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -45.96 -53.22 2.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.224 -0.444 . . . . 74.35 111.337 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -47.93 -38.2 16.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.887 -0.597 . . . . 54.11 110.961 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -85.61 -25.57 26.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 74.22 111.059 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.789 HG23 ' O ' ' A' ' 46' ' ' ASN . 26.3 t -81.86 -25.83 9.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.343 -0.389 . . . . 62.44 111.396 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.97 -17.13 63.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.384 -0.371 . . . . 73.55 111.438 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.2 pttt -95.19 -35.37 11.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.445 -0.343 . . . . 70.24 110.941 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.4 m -86.2 -23.38 26.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.202 -0.453 . . . . 72.04 111.105 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -101.97 125.9 48.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.373 -0.376 . . . . 74.23 111.161 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.29 175.28 10.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 53.52 110.559 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.684 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -58.1 -58.28 9.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.823 0.344 . . . . 74.12 110.51 179.956 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.86 -26.08 68.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.109 -0.496 . . . . 74.33 110.578 179.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.48 -43.21 99.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.114 -0.494 . . . . 72.33 110.341 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.619 HD21 HG12 ' A' ' 26' ' ' ILE . 20.8 mt -75.04 -30.11 60.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.631 -0.713 . . . . 65.32 110.998 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 56' ' ' LYS . 14.0 t -79.14 -43.14 24.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.984 0.421 . . . . 65.44 110.759 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.9 m -60.27 -36.21 77.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.823 -0.626 . . . . 72.44 110.707 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.481 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -80.85 -22.31 40.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 75.22 111.0 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.785 ' HA ' HD21 ' A' ' 29' ' ' LEU . 14.2 t80 -83.76 -22.89 31.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.117 -0.492 . . . . 70.25 110.956 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.441 ' ND2' HG12 ' A' ' 60' ' ' VAL . 72.5 m-20 -84.99 -54.35 4.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 75.34 111.342 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.466 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 2.5 p-80 -61.39 -24.49 66.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.06 -0.518 . . . . 75.45 111.179 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.766 HD12 HD23 ' A' ' 29' ' ' LEU . 3.9 tt -55.39 -39.33 70.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.937 0.399 . . . . 53.11 110.835 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -78.25 -38.82 41.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.025 -0.534 . . . . 71.33 110.705 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -37.46 78.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.013 -0.54 . . . . 62.03 111.002 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 45.4 p -90.02 -9.53 48.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.079 -0.509 . . . . 51.1 111.489 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.478 ' HD3' HG11 ' A' ' 144' ' ' VAL . 0.1 OUTLIER 52.25 34.1 13.96 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.764 0.316 . . . . 75.54 111.186 179.833 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.5 mtt180 -93.63 45.18 1.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.289 -0.414 . . . . 72.44 111.048 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.599 ' CE2' HD22 ' A' ' 66' ' ' LEU . 89.9 m-85 -69.0 178.73 2.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.43 . . . . 72.51 110.824 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.3 tttt -70.77 153.01 43.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.229 -0.441 . . . . 62.12 110.872 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 176.2 -159.95 27.48 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.7 -0.762 . . . . 72.41 112.532 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 68.9 p -60.24 143.0 53.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.831 0.348 . . . . 64.43 110.928 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -177.45 -39.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 75.43 110.934 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.659 ' C ' HD12 ' A' ' 78' ' ' ILE . 4.2 m -106.46 -34.43 7.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.069 -0.514 . . . . 74.45 110.88 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.659 HD12 ' C ' ' A' ' 77' ' ' SER . 3.9 mp 60.07 158.71 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 73.41 111.121 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.479 ' N ' HG22 ' A' ' 78' ' ' ILE . 0.6 OUTLIER -81.02 96.58 7.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.465 . . . . 74.12 110.929 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.528 ' O ' HG13 ' A' ' 81' ' ' VAL . 34.3 mttt -75.25 157.58 34.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.448 . . . . 75.22 110.908 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.528 HG13 ' O ' ' A' ' 80' ' ' LYS . 7.5 m -158.7 -44.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 44.44 111.173 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.4 m 61.65 103.26 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.042 -0.526 . . . . 73.03 110.924 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -152.3 137.5 17.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 74.32 110.885 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.715 ' O ' HG13 ' A' ' 85' ' ' VAL . 6.3 mm-40 -77.3 151.77 34.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 63.21 110.972 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.715 HG13 ' O ' ' A' ' 84' ' ' GLN . 0.2 OUTLIER -167.54 -42.86 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.928 -0.578 . . . . 65.44 111.085 -179.794 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -166.35 146.62 6.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.996 -0.547 . . . . 71.55 110.898 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -78.05 91.79 4.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 72.14 110.891 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 14.5 m -143.37 141.1 26.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.212 -0.449 . . . . 73.3 111.106 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.83 -32.84 7.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.215 -0.448 . . . . 75.23 110.876 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -87.79 144.17 26.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 72.41 110.923 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -169.21 111.17 0.49 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 65.32 110.918 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -107.82 -32.9 7.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 61.44 110.878 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -154.24 115.97 4.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 74.1 110.901 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.64 87.42 0.95 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 62.14 110.914 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.8 106.58 1.69 Allowed 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.535 2.157 . . . . 72.25 112.335 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 7.2 mmmt -110.39 -32.85 6.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 72.31 110.915 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -120.66 151.76 39.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.446 . . . . 65.41 110.91 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 40.4 p -135.63 109.45 8.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 71.45 110.925 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.7 mmtp -107.36 -32.94 7.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 64.24 110.896 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -113.44 130.11 56.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 74.51 110.907 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -160.56 87.72 0.76 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 64.0 110.874 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -151.97 117.21 5.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 65.21 110.943 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.574 HG22 ' O ' ' A' ' 103' ' ' THR . 27.8 m -140.6 32.48 1.84 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.169 -0.468 . . . . 65.51 110.945 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.7 mt 60.32 103.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 35.43 110.861 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -84.5 -31.35 24.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.27 -0.423 . . . . 55.23 110.981 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -125.71 88.08 2.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 74.33 110.9 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -163.29 128.42 1.84 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.731 -0.747 . . . . 42.55 112.456 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.513 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 32.0 Cg_exo -56.7 -45.97 33.0 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.401 2.067 . . . . 73.53 112.881 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.513 ' CD ' ' N ' ' A' ' 108' ' ' PRO . 91.5 Cg_endo -82.18 -172.54 1.47 Allowed 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 123.051 2.5 . . . . 62.43 112.435 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.433 ' HE2' ' CD1' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -132.56 29.31 4.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 70.4 110.967 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 19.1 p90 -130.88 151.06 51.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 72.44 110.819 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 4.8 m -120.27 128.7 53.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.272 -0.422 . . . . 74.12 110.683 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -124.66 144.25 50.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.338 -0.392 . . . . 71.21 111.0 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.1 t -145.36 117.18 8.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 62.43 110.909 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 24.1 t -74.78 107.31 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 74.4 111.147 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.415 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.9 mm? -77.45 -53.93 7.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 72.42 111.005 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -120.68 108.19 13.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 73.44 111.096 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.75 149.63 21.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 74.11 110.87 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.522 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -121.88 -155.04 9.32 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.637 -0.792 . . . . 71.31 112.662 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -37.93 -53.4 1.34 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.964 0.411 . . . . 73.23 111.436 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.65 36.04 1.32 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.87 -0.604 . . . . 75.31 110.18 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 24.2 m -153.53 -44.09 0.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.645 -0.707 . . . . 70.41 110.663 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -92.82 96.71 10.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 62.54 110.819 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -108.76 151.27 41.67 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 73.32 110.893 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.693 ' HB3' HG11 ' A' ' 166' ' ' VAL . 52.9 Cg_exo -55.04 125.59 19.7 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.517 2.145 . . . . 51.24 112.36 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -101.91 145.55 29.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.098 -0.501 . . . . 74.52 110.9 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -55.21 113.32 1.34 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.255 -0.429 . . . . 63.4 110.95 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.23 -19.61 48.05 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.644 -0.789 . . . . 72.01 112.577 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.59 138.22 31.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.8 0.333 . . . . 75.44 110.823 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.6 HG12 ' HG3' ' A' ' 165' ' ' LYS . 20.8 m -68.58 172.1 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.05 0.452 . . . . 73.25 111.415 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.899 HG22 ' O ' ' A' ' 164' ' ' PHE . 19.5 m -156.75 144.36 10.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.612 -0.722 . . . . 74.43 110.19 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.564 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -127.76 117.85 22.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.759 0.314 . . . . 71.24 110.99 -179.85 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.459 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 27.0 p -154.76 168.82 25.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.36 -0.382 . . . . 72.13 111.093 -179.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.564 ' O ' HG13 ' A' ' 218' ' ' VAL . 75.5 m95 -102.18 161.58 13.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.057 -0.52 . . . . 64.43 110.129 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.504 ' OH ' HD13 ' A' ' 162' ' ' LEU . 14.1 p90 -159.27 135.05 8.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.042 0.449 . . . . 72.21 111.65 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.94 HG21 HG11 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -127.45 112.92 15.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.792 -0.64 . . . . 71.55 110.394 179.65 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.558 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.94 144.88 17.6 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.564 -0.827 . . . . 64.01 113.137 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.727 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -151.25 140.64 21.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.725 0.298 . . . . 65.15 110.473 179.695 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.43 HD21 HG23 ' A' ' 208' ' ' ILE . 99.2 mt -78.09 -178.04 5.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.325 -0.398 . . . . 72.51 111.173 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -59.04 -42.89 91.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.969 -0.559 . . . . 74.13 110.857 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.31 -4.68 37.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.976 -0.556 . . . . 74.43 111.413 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' GLY . . . . . 0.498 ' C ' HG22 ' A' ' 138' ' ' THR . . . 89.47 22.0 38.8 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.687 -0.768 . . . . 74.31 112.696 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.85 108.31 19.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.859 0.362 . . . . 73.5 110.683 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.672 ' CG1' HG23 ' A' ' 138' ' ' THR . 3.5 m -68.33 130.33 33.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 64.43 111.247 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.499 ' HB3' HD11 ' A' ' 208' ' ' ILE . 34.8 p90 -110.95 -31.04 7.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 62.21 110.919 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -140.23 124.8 18.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 74.43 110.983 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.843 HG23 HG23 ' A' ' 136' ' ' THR . 29.4 m -142.59 102.86 4.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 61.23 110.736 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 45.3 t30 -76.15 -6.27 50.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 73.11 111.387 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.688 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.6 mp -95.54 115.98 35.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.844 0.354 . . . . 63.13 111.036 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.56 -74.73 0.64 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.153 -0.476 . . . . 74.13 110.903 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 72.3 p -142.18 166.01 25.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.27 -0.423 . . . . 73.53 110.893 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 14.7 m -82.72 170.2 15.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 41.14 110.927 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -80.96 -27.42 36.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 52.21 111.172 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.05 -31.89 65.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.31 -0.405 . . . . 70.43 111.043 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 20.2 tttp -89.63 -33.82 16.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.445 . . . . 60.44 110.857 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -177.17 138.27 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 72.45 110.857 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.49 77.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 75.12 110.843 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -142.27 47.62 1.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 74.33 110.835 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -140.23 120.79 14.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.459 . . . . 53.05 111.083 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 17.9 mttt -146.42 109.16 4.19 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 73.33 110.917 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.404 ' HB2' ' HB3' ' A' ' 132' ' ' HIS . 77.2 Cg_exo -50.63 150.37 12.18 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.442 2.095 . . . . 64.31 112.327 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.504 HD13 ' OH ' ' A' ' 135' ' ' TYR . 3.7 tt -74.21 119.28 18.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 60.24 110.631 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.703 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.45 122.1 42.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.885 0.374 . . . . 72.12 111.237 -179.813 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.899 ' O ' HG22 ' A' ' 131' ' ' VAL . 6.8 p90 -151.52 143.1 23.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 74.43 110.874 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.6 ' HG3' HG12 ' A' ' 130' ' ' VAL . 64.3 mttt -78.0 138.28 38.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.037 0.446 . . . . 60.54 111.151 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.693 HG11 ' HB3' ' A' ' 125' ' ' PRO . 28.6 m -87.78 149.11 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.831 -0.622 . . . . 74.11 111.133 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.03 22.57 78.48 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.858 -0.687 . . . . 60.33 112.737 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.561 HG22 ' O ' ' A' ' 165' ' ' LYS . 17.9 m -128.55 42.87 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.846 0.355 . . . . 52.44 111.172 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 40.48 38.19 1.39 Allowed Glycine 0 C--N 1.333 0.391 0 CA-C-N 116.013 -0.54 . . . . 74.31 113.461 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.64 -47.1 10.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.862 0.363 . . . . 74.41 111.131 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.9 m -112.04 -179.9 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.072 -0.513 . . . . 71.22 111.079 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.549 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -60.54 160.62 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.303 -0.408 . . . . 72.25 111.377 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 173' ' ' ARG . . . . . 0.405 ' HA ' ' OD2' ' A' ' 176' ' ' ASP . 27.6 ttt180 -67.72 -25.83 65.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.1 -0.5 . . . . 75.35 111.285 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -80.31 -33.69 31.33 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.63 -0.795 . . . . 60.13 112.399 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.783 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.5 t90 -80.8 -35.69 32.68 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.071 0.397 . . . . 70.11 112.071 -179.157 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 176' ' ' ASP . . . . . 0.405 ' OD2' ' HA ' ' A' ' 173' ' ' ARG . 7.0 p30 -73.04 -31.35 64.37 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.794 0.33 . . . . 44.3 110.277 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -74.59 -30.65 61.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 72.11 110.18 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.473 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -88.0 -45.25 10.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.012 -0.54 . . . . 52.22 111.132 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.62 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 4.8 mt -57.68 -38.7 75.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.13 -0.486 . . . . 72.03 110.607 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 16.5 mt -55.4 -24.19 28.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.124 -0.489 . . . . 73.12 110.937 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.0 -3.99 56.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.227 -0.442 . . . . 54.24 111.417 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.55 154.09 27.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.776 0.322 . . . . 61.54 110.623 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.08 171.52 8.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.977 0.418 . . . . 53.41 111.447 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 184' ' ' LYS . . . . . 0.61 ' HA ' HD22 ' A' ' 220' ' ' LEU . 24.7 tttt -64.72 120.73 13.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.788 -0.642 . . . . 63.23 110.506 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 67.85 63.8 3.49 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.543 -0.837 . . . . 64.35 112.19 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 186' ' ' GLU . . . . . 0.522 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 22.3 tt0 -144.57 147.03 32.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.633 0.254 . . . . 74.25 110.403 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -119.42 136.53 54.26 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.271 -0.27 . . . . 71.23 110.271 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.28 168.53 19.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.105 0.479 . . . . 53.55 111.811 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.66 101.01 4.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.589 -0.732 . . . . 74.31 109.874 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.673 HD23 ' H ' ' A' ' 190' ' ' LEU . 2.2 pt? -118.92 145.33 45.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.069 0.462 . . . . 75.41 111.884 -178.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.722 ' HB3' HG23 ' A' ' 215' ' ' THR . 16.2 pt-20 -118.14 116.21 26.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.625 -0.716 . . . . 74.23 110.248 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 192' ' ' ILE . . . . . . . . . . . . . 25.5 mt -106.89 128.7 61.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.279 -0.419 . . . . 64.44 111.589 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -61.65 164.9 8.42 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.902 -0.59 . . . . 74.22 110.615 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 194' ' ' PRO . . . . . 0.439 ' HG3' ' HA ' ' A' ' 211' ' ' ASN . 19.6 Cg_endo -58.68 -40.04 76.92 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.591 2.194 . . . . 64.31 112.291 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -53.54 -28.27 30.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 64.04 111.302 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.433 ' CD1' ' HE2' ' A' ' 110' ' ' LYS . 13.8 m0 -110.24 35.3 3.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.845 0.355 . . . . 74.15 111.091 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 197' ' ' ALA . . . . . 0.433 ' CB ' HD12 ' A' ' 214' ' ' LEU . . . -153.74 -79.93 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 74.23 111.071 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -108.37 -33.69 7.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.405 . . . . 72.13 110.771 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 111.36 177.7 20.32 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.827 -0.701 . . . . 60.55 112.652 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -59.22 -36.32 75.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 70.21 110.838 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.13 -53.15 61.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 62.42 110.653 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 119.95 -151.81 17.25 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.943 -0.646 . . . . 73.12 112.494 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.4 ' CB ' ' HB ' ' A' ' 208' ' ' ILE . 0.6 OUTLIER -143.98 78.14 14.16 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.905 0.383 . . . . 72.53 110.579 179.929 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -55.65 -21.7 32.79 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.599 2.2 . . . . 72.14 112.381 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.52 -42.12 99.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.419 -0.355 . . . . 74.52 110.955 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -111.9 22.68 14.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.188 -0.46 . . . . 65.52 111.356 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 21.5 mttp 58.52 54.46 5.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.916 0.389 . . . . 73.0 111.057 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.499 HD11 ' HB3' ' A' ' 145' ' ' PHE . 23.0 mm -108.81 111.81 60.67 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 72.01 111.017 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.75 163.2 3.04 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.475 2.117 . . . . 73.32 112.447 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.04 128.72 13.37 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.634 2.222 . . . . 71.44 112.338 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 211' ' ' ASN . . . . . 0.439 ' HA ' ' HG3' ' A' ' 194' ' ' PRO . 22.8 m-80 62.6 66.99 0.73 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.249 -0.432 . . . . 73.2 110.908 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.87 129.74 51.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.264 -0.425 . . . . 74.44 111.539 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 213' ' ' LYS . . . . . 0.514 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.0 OUTLIER -65.4 143.95 57.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.942 -0.572 . . . . 74.03 110.469 179.718 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.514 HD23 ' O ' ' A' ' 213' ' ' LYS . 9.6 mt -126.94 109.58 12.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.94 0.4 . . . . 63.55 111.779 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.722 HG23 ' HB3' ' A' ' 191' ' ' GLU . 2.7 m -107.67 138.05 44.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.974 -0.557 . . . . 75.21 110.436 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.558 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 22.7 p90 -152.41 175.31 12.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.094 0.473 . . . . 73.1 111.542 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -130.28 134.1 46.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.734 -0.666 . . . . 64.33 110.432 179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.783 HG21 ' HE1' ' A' ' 175' ' ' TRP . 5.8 t -121.73 150.43 25.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.997 0.427 . . . . 74.31 111.898 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -136.94 109.22 7.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.762 -0.654 . . . . 75.13 110.233 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.698 HD21 ' CG1' ' A' ' 223' ' ' ILE . 1.9 tt -70.06 133.25 47.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.504 -0.316 . . . . 63.43 110.975 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.402 ' N ' HD23 ' A' ' 220' ' ' LEU . 21.9 t -112.62 -29.53 2.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.238 -0.437 . . . . 70.33 111.451 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 222' ' ' ASP . . . . . 0.422 ' N ' HD23 ' A' ' 220' ' ' LEU . 9.4 t70 -169.03 158.59 8.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.907 0.384 . . . . 74.32 111.157 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.784 HG23 HG12 ' A' ' 131' ' ' VAL . 30.7 mt -141.52 111.53 3.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.109 -0.496 . . . . 74.31 111.182 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 224' ' ' ASP . . . . . 0.534 ' C ' HG22 ' A' ' 130' ' ' VAL . 33.8 t70 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.245 -0.434 . . . . 63.52 110.871 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.832 0.349 . . . . 74.15 111.163 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.78 112.93 26.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.474 . . . . 73.1 111.084 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -101.6 107.4 18.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 63.54 111.108 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.588 ' CB ' HG22 ' A' ' 215' ' ' THR . . . -85.98 174.61 9.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 63.21 111.067 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 1.059 HG11 HG21 ' A' ' 136' ' ' THR . 29.9 t -60.18 110.54 2.93 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.467 . . . . 62.52 111.103 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -79.68 142.53 16.16 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.65 2.234 . . . . 62.1 112.449 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -78.54 147.91 33.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.244 -0.435 . . . . 63.13 110.785 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.97 96.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.213 -0.449 . . . . 74.22 111.285 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.539 ' HB2' ' NZ ' ' A' ' 187' ' ' LYS . . . -66.99 -15.62 63.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 50.32 111.379 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.514 ' NE1' HD11 ' A' ' 20' ' ' LEU . 2.0 m-90 -135.64 173.79 11.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.907 0.384 . . . . 73.31 110.794 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.461 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.3 OUTLIER -117.0 153.26 32.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.978 -0.555 . . . . 72.33 110.517 179.661 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.583 HG12 ' HD2' ' A' ' 16' ' ' ARG . 31.7 t -56.31 -34.05 39.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.396 . . . . 74.45 110.975 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -72.8 -25.67 61.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.532 . . . . 44.13 111.197 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.461 ' HB2' HG23 ' A' ' 11' ' ' THR . 17.5 mt-30 -82.15 -56.57 3.85 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.821 0.343 . . . . 75.23 111.122 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.602 ' HB3' HG22 ' A' ' 60' ' ' VAL . 14.0 mt -49.55 -64.36 0.83 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.284 -0.417 . . . . 63.21 111.123 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.583 ' HD2' HG12 ' A' ' 12' ' ' VAL . 4.7 mtt-85 -54.45 -25.46 25.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.5 . . . . 73.34 111.345 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.13 173.24 0.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.023 0.44 . . . . 73.43 111.31 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -108.25 16.99 22.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.766 -0.652 . . . . 63.13 110.945 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.5 tp60 -107.75 -23.61 12.02 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.386 -0.37 . . . . 74.4 111.065 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.814 HD22 HD11 ' A' ' 25' ' ' ILE . 10.0 tt -93.17 116.19 66.12 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.407 -0.36 . . . . 73.22 111.029 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -57.2 126.6 22.61 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.478 2.118 . . . . 74.12 112.198 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -24.11 67.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 64.42 111.203 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.538 ' HA ' HD12 ' A' ' 26' ' ' ILE . 26.4 mmtt -53.74 -36.87 62.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.375 -0.375 . . . . 71.41 111.292 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -72.67 -57.22 4.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.266 -0.425 . . . . 73.51 111.021 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.814 HD11 HD22 ' A' ' 20' ' ' LEU . 36.5 mt -44.77 -30.56 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.892 -0.594 . . . . 71.23 111.466 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.737 ' HB ' HG23 ' A' ' 47' ' ' ILE . 7.7 mt -78.08 -38.83 24.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.931 0.396 . . . . 74.03 111.03 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 mtpt -73.78 -24.9 59.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.96 -0.564 . . . . 53.01 111.131 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -72.96 -45.19 59.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.923 0.392 . . . . 75.52 110.842 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.844 HD23 HD12 ' A' ' 66' ' ' LEU . 3.2 mt -69.27 -24.53 63.98 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.911 -0.586 . . . . 75.22 111.033 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.52 ' HA ' HD11 ' A' ' 38' ' ' LEU . 64.8 mt-30 -80.0 -26.89 39.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.407 . . . . 61.45 111.112 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.425 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -101.8 -1.3 32.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.415 -0.357 . . . . 60.23 111.593 -179.889 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.425 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.7 m-70 -132.6 -10.9 3.14 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.857 0.317 . . . . 74.54 111.857 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.86 105.49 0.81 Allowed Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.603 -0.808 . . . . 54.11 112.372 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -31.94 152.48 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.544 0.572 . . . . 63.45 112.544 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.579 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.6 p-10 -50.09 -56.8 9.41 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.692 -0.685 . . . . 71.21 111.292 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.52 -49.96 17.82 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.032 0.444 . . . . 71.42 110.77 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.453 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 2.4 t80 -52.99 -47.26 68.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.786 -0.643 . . . . 74.1 110.321 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.693 HD21 ' O ' ' A' ' 29' ' ' LEU . 12.1 mt -66.86 -41.48 87.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.938 -0.574 . . . . 65.44 110.853 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.838 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -48.64 -41.84 32.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.093 0.473 . . . . 43.53 110.75 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -49.4 -48.28 47.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.678 -0.692 . . . . 63.3 110.93 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.418 ' CD2' ' N ' ' A' ' 41' ' ' HIS . 2.9 m-70 -103.89 14.86 29.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.042 -0.526 . . . . 74.34 111.201 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 4.8 mtmm 55.51 42.14 30.09 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.889 0.376 . . . . 51.14 111.1 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.708 HD13 HD13 ' A' ' 29' ' ' LEU . 20.3 mt -93.24 -19.43 21.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 65.44 111.532 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.838 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.73 157.81 27.07 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.04 0.448 . . . . 71.41 111.077 -179.863 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.73 -121.55 5.13 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.747 -0.661 . . . . 51.13 112.379 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.787 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.4 OUTLIER -116.36 116.88 28.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.773 0.321 . . . . 54.41 110.92 179.917 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.737 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.9 -54.72 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.237 -0.438 . . . . 73.32 111.33 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -47.09 -36.75 8.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 74.51 110.849 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -85.67 -26.03 26.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.93 -0.577 . . . . 73.12 110.959 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 46' ' ' ASN . 22.8 t -79.8 -26.03 12.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.293 -0.412 . . . . 70.51 111.353 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.61 -23.13 66.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 53.42 111.126 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.21 -30.43 14.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 54.23 110.758 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.2 m -98.2 33.74 2.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 62.14 111.053 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -165.4 135.05 3.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 45.23 111.027 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -94.03 177.33 6.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 74.11 110.964 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.629 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -56.04 -57.79 10.63 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.26 -0.427 . . . . 73.23 111.053 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -58.73 -28.31 65.73 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 70.33 110.577 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.27 -47.25 85.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.957 -0.565 . . . . 54.33 110.905 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.688 HD21 HG12 ' A' ' 26' ' ' ILE . 31.7 mt -73.9 -30.94 62.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.654 -0.703 . . . . 74.41 111.283 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.629 HG23 ' O ' ' A' ' 56' ' ' LYS . 22.3 t -78.84 -43.23 25.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.986 0.422 . . . . 73.34 111.007 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 96.6 m -60.48 -37.84 82.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.945 -0.571 . . . . 72.41 110.71 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.479 ' HB3' HD11 ' A' ' 43' ' ' LEU . . . -78.21 -23.41 47.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 62.24 111.081 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.666 ' HA ' HD21 ' A' ' 29' ' ' LEU . 19.2 t80 -83.96 -53.52 5.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.148 0.499 . . . . 71.14 110.656 179.415 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.585 ' ND2' HG12 ' A' ' 60' ' ' VAL . 31.2 m-20 -50.56 -57.01 9.15 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.514 -0.766 . . . . 73.24 111.371 -179.569 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.459 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 3.0 p-80 -63.47 -24.86 68.01 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.155 -0.475 . . . . 73.43 111.193 -179.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.844 HD12 HD23 ' A' ' 29' ' ' LEU . 3.7 tt -51.95 -41.39 62.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.907 0.384 . . . . 54.21 110.891 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -79.04 -40.09 32.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.975 -0.557 . . . . 73.25 110.553 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -62.39 -45.19 94.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.979 -0.555 . . . . 65.42 110.676 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 72.7 p -90.75 -1.99 57.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.93 -0.577 . . . . 64.23 111.346 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.1 pttt 45.06 42.16 6.24 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.794 0.331 . . . . 74.12 111.554 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -92.11 47.24 1.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 73.25 110.884 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.517 ' CE2' HD22 ' A' ' 66' ' ' LEU . 87.3 m-85 -73.05 -175.0 1.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 75.31 110.924 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.6 tttt -75.25 153.01 38.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.415 . . . . 75.4 110.857 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -122.67 -143.81 6.53 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.771 -0.728 . . . . 62.11 112.49 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.58 99.47 8.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.827 0.346 . . . . 73.22 110.879 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -108.42 -32.55 7.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.455 . . . . 62.43 110.856 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.765 ' O ' HD13 ' A' ' 78' ' ' ILE . 4.1 m -95.79 150.67 20.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 71.34 110.91 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.765 HD13 ' O ' ' A' ' 77' ' ' SER . 25.0 mm -140.64 92.44 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 73.51 111.118 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.8 t -75.04 -33.34 61.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 74.41 110.948 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.8 ttpt 60.09 109.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 75.54 110.946 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -93.32 81.97 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.459 . . . . 74.51 111.129 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -176.82 138.91 0.28 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 73.24 110.893 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -177.9 -39.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 70.11 110.874 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -82.88 102.54 11.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.098 -0.501 . . . . 52.34 110.918 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -133.32 101.52 4.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 75.42 111.127 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -147.99 131.28 16.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 63.23 110.913 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.491 ' O ' HG13 ' A' ' 88' ' ' VAL . 1.7 t-20 -73.84 102.47 4.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 63.43 110.901 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.597 HG21 ' HB2' ' A' ' 91' ' ' ASN . 6.7 m -157.67 166.76 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 71.31 111.147 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.1 -32.07 11.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 75.52 110.928 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.3 tt -142.48 107.71 4.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 73.12 110.894 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.597 ' HB2' HG21 ' A' ' 88' ' ' VAL . 9.3 t-20 -136.24 112.26 9.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 53.03 110.908 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -157.4 152.19 25.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.145 -0.48 . . . . 65.3 110.895 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -177.11 -39.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 65.13 110.954 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -169.28 143.99 2.48 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.088 -0.506 . . . . 72.23 110.879 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.77 139.85 58.12 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.453 2.102 . . . . 72.35 112.304 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -109.14 -29.77 8.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 70.45 110.972 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -130.32 -79.05 0.54 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.456 . . . . 74.51 110.939 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.64 102.87 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.203 -0.453 . . . . 75.41 110.934 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.5 mttt -141.54 127.99 20.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 75.34 110.945 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.8 m 60.91 91.81 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 73.32 110.894 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.67 100.95 7.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 62.12 110.94 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -106.46 144.34 33.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 55.43 110.919 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 20.8 p -131.77 151.7 51.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.21 -0.45 . . . . 74.04 110.875 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -159.18 149.25 19.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 72.3 110.94 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -151.83 -173.12 4.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 64.21 110.888 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 62.49 -80.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.111 -0.495 . . . . 73.35 111.041 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 169.92 80.98 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.799 -0.715 . . . . 45.44 112.477 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.19 154.77 65.72 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.597 2.198 . . . . 45.15 112.301 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -68.89 -166.94 0.17 Allowed 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.577 2.185 . . . . 73.11 112.28 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.439 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -97.49 30.69 2.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 75.4 110.962 179.987 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.403 ' CE1' ' HB2' ' A' ' 178' ' ' ALA . 47.3 p90 -151.98 163.73 38.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 73.11 110.852 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.433 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 64.1 m -130.2 103.57 6.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 73.55 110.939 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.46 146.42 34.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 75.21 110.897 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.531 ' O ' HD12 ' A' ' 116' ' ' LEU . 2.1 m -142.23 125.75 16.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 72.14 110.925 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.517 HG13 ' CD ' ' A' ' 186' ' ' GLU . 41.8 t -72.68 106.11 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 62.44 111.451 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.531 HD12 ' O ' ' A' ' 114' ' ' SER . 6.8 mp -75.62 -60.71 2.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 73.32 110.484 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.0 ttpp -111.62 108.07 17.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.954 -0.566 . . . . 73.44 110.64 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.4 mtpt -60.21 137.37 58.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.26 -0.427 . . . . 63.21 111.024 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -104.19 -106.01 3.05 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.762 -0.733 . . . . 61.33 112.198 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.22 -43.94 11.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.958 0.408 . . . . 75.23 110.589 179.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 71.05 36.44 1.42 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.909 -0.587 . . . . 72.51 110.679 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 60.1 m -163.97 -43.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.017 -0.538 . . . . 74.21 110.768 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.35 91.72 6.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 73.21 110.952 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -103.34 149.89 37.43 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.129 -0.487 . . . . 71.33 110.906 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.613 ' HB2' HG21 ' A' ' 166' ' ' VAL . 61.2 Cg_endo -73.14 125.66 10.5 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.597 2.198 . . . . 75.03 112.387 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.91 159.38 15.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 72.55 110.8 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.418 ' HG2' ' HA3' ' A' ' 167' ' ' GLY . 0.0 OUTLIER -58.53 118.45 5.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.343 -0.39 . . . . 74.33 110.965 -179.947 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 103.0 -17.72 51.6 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.762 -0.732 . . . . 4.34 112.499 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.41 133.35 35.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.902 0.382 . . . . 74.23 110.903 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.566 HG12 ' O ' ' A' ' 224' ' ' ASP . 5.7 p -69.96 162.8 3.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.506 . . . . 63.13 110.848 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.77 HG22 ' O ' ' A' ' 164' ' ' PHE . 5.4 m -153.16 144.85 15.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.206 -0.452 . . . . 61.31 111.048 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.597 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -127.48 117.8 22.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.768 0.318 . . . . 71.33 110.725 179.68 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.488 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.1 p -154.76 168.87 25.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.901 0.381 . . . . 65.35 111.067 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.525 ' O ' HG13 ' A' ' 218' ' ' VAL . 65.2 m95 -102.91 162.62 12.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.012 -0.54 . . . . 71.43 110.195 179.45 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.69 ' H ' HD11 ' A' ' 149' ' ' ILE . 33.2 p90 -159.93 135.2 8.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.982 0.42 . . . . 72.53 111.458 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' THR . . . . . 1.059 HG21 HG11 ' A' ' 5' ' ' VAL . 6.8 m -129.32 115.38 17.5 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.847 -0.615 . . . . 62.31 110.337 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.597 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.82 144.26 17.15 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.619 -0.8 . . . . 73.35 113.108 -179.478 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.74 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -148.11 145.98 28.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.784 0.326 . . . . 74.22 110.548 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 21.9 mt -82.27 -177.97 6.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.277 -0.42 . . . . 64.24 111.159 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -57.63 -42.48 83.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 72.32 110.937 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.94 -5.4 46.0 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.016 -0.538 . . . . 50.53 111.405 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.64 25.84 26.64 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.64 -0.79 . . . . 73.53 112.546 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -95.35 112.2 23.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.339 . . . . 53.12 110.771 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.574 ' CG1' HG23 ' A' ' 138' ' ' THR . 2.5 m -63.6 144.15 14.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.436 . . . . 73.52 111.17 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.434 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 42.2 p90 -120.92 -36.56 3.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 73.53 111.284 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' ASP . . . . . 0.404 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 59.7 m-20 -158.07 118.04 3.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.906 0.384 . . . . 71.21 111.355 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.444 ' OG1' HG23 ' A' ' 136' ' ' THR . 14.7 t -142.94 129.46 20.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.514 . . . . 64.5 110.491 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.692 ' C ' HD12 ' A' ' 149' ' ' ILE . 19.8 p-10 -96.22 39.32 1.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.8 0.333 . . . . 74.33 111.1 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.692 HD12 ' C ' ' A' ' 148' ' ' ASN . 2.7 mp -125.64 118.04 51.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 74.31 110.713 179.754 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -118.29 -77.17 0.57 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.233 -0.439 . . . . 64.33 110.918 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 25.2 p -146.5 166.03 27.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.441 . . . . 62.22 110.942 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.6 m -85.19 -176.33 6.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 72.41 110.892 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -75.25 -23.7 57.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 73.01 111.29 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.6 pttp -54.88 -30.0 57.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.373 -0.376 . . . . 70.43 111.087 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -91.29 -38.17 12.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 74.23 110.89 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 30.0 pttt -179.18 156.89 0.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.061 -0.518 . . . . 61.42 110.859 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 4.9 mtmt -86.12 76.22 9.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 55.11 110.892 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -154.12 47.67 0.61 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.479 . . . . 74.15 110.835 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.19 111.48 2.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.056 -0.52 . . . . 63.44 111.04 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -136.83 138.4 26.01 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 73.05 110.904 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.76 151.62 31.6 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.384 2.056 . . . . 72.41 112.359 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.569 ' O ' HD23 ' A' ' 162' ' ' LEU . 4.6 tt -76.08 119.95 20.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 61.23 110.572 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.62 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -98.68 122.17 41.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.907 0.384 . . . . 72.51 111.273 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.77 ' O ' HG22 ' A' ' 131' ' ' VAL . 8.4 p90 -151.62 143.55 23.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.014 -0.539 . . . . 75.1 110.724 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.532 ' O ' HG22 ' A' ' 168' ' ' VAL . 14.7 mtmm -80.92 139.11 36.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.082 0.468 . . . . 74.42 111.129 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.613 HG21 ' HB2' ' A' ' 125' ' ' PRO . 34.1 m -87.46 149.46 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.71 -0.677 . . . . 70.23 111.44 -179.127 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 167' ' ' GLY . . . . . 0.418 ' HA3' ' HG2' ' A' ' 127' ' ' LYS . . . 70.51 22.54 77.84 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.82 -0.627 . . . . 64.14 112.768 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.614 HG23 ' CG ' ' A' ' 170' ' ' LYS . 17.1 m -129.38 42.29 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 75.42 111.096 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.69 37.47 5.14 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 121.143 -0.551 . . . . 73.22 113.088 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 170' ' ' LYS . . . . . 0.614 ' CG ' HG23 ' A' ' 168' ' ' VAL . 3.0 mmpt? -86.02 -36.8 19.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.819 0.342 . . . . 61.52 111.131 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.6 m -126.76 179.39 3.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.457 . . . . 72.21 111.19 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.543 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -60.57 159.45 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 73.21 111.301 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -67.41 -27.8 67.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 74.41 111.199 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.96 -36.97 39.75 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.662 -0.78 . . . . 74.04 112.059 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.67 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.4 t90 -78.3 -34.15 48.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.957 0.408 . . . . 74.21 111.113 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 176' ' ' ASP . . . . . 0.808 ' O ' HD13 ' A' ' 180' ' ' LEU . 35.1 t70 -66.78 -32.21 73.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.948 -0.569 . . . . 54.43 110.675 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -79.06 -29.82 43.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.48 . . . . 72.33 110.837 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.656 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -82.58 -52.38 6.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.234 -0.439 . . . . 75.44 111.181 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.566 HD21 ' NE1' ' A' ' 175' ' ' TRP . 10.2 mt -58.4 -34.89 71.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.988 -0.551 . . . . 73.22 110.842 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.808 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.6 mp -53.68 -37.62 63.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 70.3 111.084 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 39.2 p -84.18 1.99 41.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.037 -0.529 . . . . 73.03 111.518 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.15 151.38 33.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.765 0.317 . . . . 71.24 110.863 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.72 165.76 11.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.291 -0.413 . . . . 71.42 110.938 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.89 124.97 23.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.08 -0.509 . . . . 73.02 111.021 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 67.8 44.15 81.25 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.84 -0.695 . . . . 63.22 112.841 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 186' ' ' GLU . . . . . 0.517 ' CD ' HG13 ' A' ' 115' ' ' VAL . 13.4 tt0 -126.91 149.94 49.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.581 0.229 . . . . 52.2 110.528 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 187' ' ' LYS . . . . . 0.539 ' NZ ' ' HB2' ' A' ' 9' ' ' ALA . 4.7 ttmt -117.95 138.17 52.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.098 -0.334 . . . . 64.43 110.098 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -148.23 175.85 10.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.075 0.464 . . . . 54.4 111.846 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.13 133.6 33.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.607 -0.724 . . . . 71.33 109.584 178.726 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.656 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.1 pt? -140.34 141.18 35.69 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.158 0.504 . . . . 73.53 112.045 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.68 110.36 18.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.587 -0.733 . . . . 72.04 110.257 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.482 HD11 ' CZ ' ' A' ' 216' ' ' PHE . 2.1 mp -96.25 139.44 19.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.916 0.389 . . . . 74.12 111.344 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -73.64 166.38 44.69 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.945 -0.57 . . . . 74.35 110.964 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.56 -14.34 41.87 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.676 2.25 . . . . 73.44 112.608 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -80.38 -30.01 37.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.814 0.34 . . . . 72.43 111.028 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.439 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 15.3 m0 -111.06 36.9 2.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.29 -0.413 . . . . 71.33 111.004 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -153.16 -78.4 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.256 -0.429 . . . . 74.52 111.018 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 198' ' ' TYR . . . . . 0.668 ' CE2' HD11 ' A' ' 214' ' ' LEU . 24.0 m-85 -106.92 -71.17 0.76 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 62.1 110.792 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 145.74 176.04 19.32 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.83 -0.7 . . . . 51.43 112.596 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -57.5 -25.58 60.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.728 0.299 . . . . 72.22 111.005 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -74.68 -52.02 12.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.998 0.427 . . . . 74.25 110.863 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.78 174.01 24.67 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.854 -0.689 . . . . 54.21 112.533 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.429 ' CB ' HD12 ' A' ' 208' ' ' ILE . 0.0 OUTLIER -106.32 91.27 5.54 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.66 0.267 . . . . 75.1 110.845 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 204' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 203' ' ' GLN . 37.4 Cg_endo -66.22 -21.61 54.84 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.509 2.139 . . . . 74.01 112.445 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.39 -41.84 94.65 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.383 -0.371 . . . . 71.11 110.932 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -105.96 30.0 6.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 72.32 111.126 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 21.6 mttp 56.8 29.43 16.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 72.24 111.044 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.606 HD13 ' CE2' ' A' ' 198' ' ' TYR . 30.3 mt -91.11 111.77 50.3 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.304 -0.407 . . . . 60.42 111.013 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -68.55 171.23 13.43 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.461 2.107 . . . . 73.31 112.401 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -67.01 145.84 75.16 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.587 2.191 . . . . 74.41 112.253 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 48.92 73.61 0.22 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.255 -0.429 . . . . 71.25 111.152 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -127.37 113.66 16.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.312 -0.404 . . . . 50.24 111.479 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.08 116.5 6.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.054 -0.521 . . . . 74.04 110.44 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.668 HD11 ' CE2' ' A' ' 198' ' ' TYR . 11.1 mt -93.46 109.87 21.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.162 -0.472 . . . . 63.14 111.568 -179.26 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.588 HG22 ' CB ' ' A' ' 4' ' ' ALA . 96.4 m -107.43 138.13 44.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.935 -0.575 . . . . 65.15 110.303 179.524 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.597 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 14.9 p90 -155.33 179.38 9.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.082 0.467 . . . . 73.24 111.552 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -133.48 136.85 45.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.686 -0.688 . . . . 75.31 110.748 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.67 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.0 t -121.8 151.21 25.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.168 -0.469 . . . . 34.41 111.756 -179.072 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -136.74 108.78 7.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.793 -0.639 . . . . 71.22 110.365 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.892 HD13 HD11 ' A' ' 223' ' ' ILE . 0.7 OUTLIER -69.83 128.56 36.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.364 -0.38 . . . . 61.32 110.829 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 39.3 t -108.7 -30.05 2.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.25 -0.432 . . . . 71.2 111.023 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -167.14 156.81 10.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.354 -0.384 . . . . 72.42 110.948 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.892 HD11 HD13 ' A' ' 220' ' ' LEU . 4.4 mp -142.75 112.35 2.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.239 -0.437 . . . . 75.43 111.097 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 224' ' ' ASP . . . . . 0.566 ' O ' HG12 ' A' ' 130' ' ' VAL . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 61.52 110.89 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.854 0.359 . . . . 64.0 111.149 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.7 105.1 15.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 72.01 111.107 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -158.68 59.56 0.43 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 74.42 111.037 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -164.55 123.91 1.9 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 43.11 111.052 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 1.037 HG11 HG21 ' A' ' 136' ' ' THR . 44.7 t -60.21 110.46 2.87 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 72.12 110.951 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.443 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 80.3 Cg_endo -78.56 141.96 18.0 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.713 2.275 . . . . 62.02 112.473 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.406 HE22 HD11 ' A' ' 149' ' ' ILE . 5.5 mm100 -79.91 149.35 30.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.126 -0.488 . . . . 73.45 110.975 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.429 ' HD2' HD13 ' A' ' 149' ' ' ILE . 0.0 OUTLIER -49.86 116.61 1.88 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 72.04 111.162 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.29 -13.9 34.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.146 -0.479 . . . . 55.23 111.576 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.678 ' CD1' HD11 ' A' ' 20' ' ' LEU . 2.0 m-90 -137.94 173.73 11.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.961 0.41 . . . . 73.41 110.966 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 m -117.51 151.8 36.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.944 -0.571 . . . . 51.33 110.741 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.554 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.8 t -56.7 -33.09 39.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.948 0.404 . . . . 63.51 110.824 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -75.4 -25.61 57.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.949 -0.568 . . . . 75.32 111.017 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -82.12 -57.45 3.39 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.831 0.348 . . . . 74.14 110.929 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.708 HD23 HG12 ' A' ' 25' ' ' ILE . 1.0 OUTLIER -49.7 -62.98 1.25 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.241 -0.436 . . . . 70.42 111.006 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.554 ' HD2' HG12 ' A' ' 12' ' ' VAL . 17.9 mtt180 -54.07 -24.09 16.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.087 -0.506 . . . . 70.22 111.291 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.31 176.84 0.11 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.891 0.377 . . . . 72.41 111.168 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -110.38 16.81 21.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.98 -0.554 . . . . 72.55 111.194 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -108.9 -24.81 11.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.521 -0.309 . . . . 75.43 111.165 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.678 HD11 ' CD1' ' A' ' 10' ' ' TRP . 1.8 tt -90.95 111.69 49.59 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.388 -0.369 . . . . 75.11 111.03 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -55.97 128.09 28.8 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.448 2.099 . . . . 75.22 112.211 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.874 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -62.66 -24.16 67.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 73.32 111.222 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.468 ' HA ' HD12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -52.04 -41.62 62.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.425 -0.352 . . . . 75.3 111.472 -179.747 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.95 -57.34 4.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.197 -0.456 . . . . 53.01 111.104 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.874 HD12 ' HA ' ' A' ' 22' ' ' LYS . 4.9 mt -44.96 -30.49 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.858 -0.61 . . . . 70.4 111.613 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.665 HG12 HD21 ' A' ' 59' ' ' LEU . 7.5 mt -77.74 -37.85 24.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.938 0.399 . . . . 70.24 110.969 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -73.11 -23.75 60.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.062 -0.517 . . . . 71.31 111.03 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.452 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 34.6 t80 -73.22 -47.02 46.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.06 0.457 . . . . 75.21 110.99 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.815 HD21 ' HA ' ' A' ' 63' ' ' TYR . 4.3 mt -69.11 -27.77 65.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.782 -0.645 . . . . 74.23 111.136 -179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.476 ' HA ' HD11 ' A' ' 38' ' ' LEU . 36.2 mt-30 -75.69 -29.26 58.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.405 . . . . 72.41 110.987 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.405 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 12.7 pt-20 -93.34 -39.65 10.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 71.21 111.113 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.452 ' ND1' ' CZ ' ' A' ' 28' ' ' PHE . 18.3 m170 -90.27 -5.0 56.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.294 -0.412 . . . . 64.41 111.448 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.01 161.94 15.96 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.712 -0.756 . . . . 70.45 112.425 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.81 153.38 18.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.62 0.248 . . . . 71.14 110.501 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.699 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.3 p-10 -48.83 -56.97 7.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.77 0.319 . . . . 74.42 111.066 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.14 -51.24 25.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.053 0.454 . . . . 45.24 110.803 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.508 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 16.5 t80 -53.07 -48.09 67.98 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.803 -0.635 . . . . 71.53 110.453 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.522 HD21 ' O ' ' A' ' 29' ' ' LEU . 13.3 mt -66.18 -40.67 90.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.055 -0.521 . . . . 64.23 110.775 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.767 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.65 -48.19 28.96 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.03 0.443 . . . . 34.13 111.1 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -57.33 -26.68 61.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.713 -0.676 . . . . 34.31 110.94 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.406 ' NE2' ' CE1' ' A' ' 65' ' ' HIS . 67.8 m-70 -112.57 11.07 19.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.283 -0.417 . . . . 74.54 111.248 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.89 34.79 11.0 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.817 0.341 . . . . 62.44 110.901 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.694 HD13 HD13 ' A' ' 29' ' ' LEU . 23.2 mt -93.29 -20.65 20.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 73.33 111.736 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.767 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.39 158.89 27.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.031 0.443 . . . . 71.03 111.102 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.61 -119.6 4.64 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.775 -0.648 . . . . 51.23 112.453 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.883 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.5 OUTLIER -116.4 115.16 25.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.803 0.335 . . . . 61.03 110.891 179.947 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.634 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.41 -57.66 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.164 -0.471 . . . . 73.51 111.499 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -45.68 -37.25 5.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.804 -0.634 . . . . 73.43 111.076 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -85.75 -25.92 26.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.566 . . . . 51.33 111.086 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 46' ' ' ASN . 19.2 t -81.14 -26.36 10.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.304 -0.407 . . . . 60.12 111.459 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.99 -18.02 64.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.403 -0.362 . . . . 64.33 111.365 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -95.2 -34.53 12.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.42 -0.355 . . . . 51.21 111.076 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.46 -19.74 35.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 74.22 111.409 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -116.16 139.26 50.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 64.42 111.255 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -91.42 -177.47 4.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.151 -0.477 . . . . 74.13 110.74 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.566 ' O ' HG23 ' A' ' 60' ' ' VAL . 23.1 mmmt -59.59 -58.02 10.42 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.457 -0.338 . . . . 55.33 110.91 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.94 -27.87 65.73 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.205 -0.452 . . . . 74.44 110.625 179.639 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.77 -43.11 99.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.958 -0.564 . . . . 72.4 110.756 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.665 HD21 HG12 ' A' ' 26' ' ' ILE . 29.1 mt -76.35 -28.85 56.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.687 -0.688 . . . . 75.1 111.196 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.6 HG22 ' HB3' ' A' ' 15' ' ' LEU . 18.2 t -80.42 -43.93 21.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.001 0.429 . . . . 72.44 110.685 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 72.4 m -59.29 -33.98 71.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.88 -0.6 . . . . 71.35 110.457 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.455 ' HB3' HD11 ' A' ' 43' ' ' LEU . . . -83.23 -21.97 33.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 62.14 110.942 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.815 ' HA ' HD21 ' A' ' 29' ' ' LEU . 15.6 t80 -83.64 -22.84 32.05 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.171 -0.468 . . . . 60.15 111.113 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.52 ' ND2' HG12 ' A' ' 60' ' ' VAL . 34.2 m-80 -84.56 -53.9 5.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.074 0.464 . . . . 70.04 111.321 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.589 ' HD2' HG21 ' A' ' 69' ' ' THR . 2.9 p-80 -60.43 -29.23 68.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.003 -0.544 . . . . 74.23 111.022 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.694 HD12 HD23 ' A' ' 29' ' ' LEU . 5.5 tt -46.73 -42.09 16.17 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.877 0.37 . . . . 71.33 110.985 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.42 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 5.8 m-85 -78.14 -41.08 36.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.997 -0.547 . . . . 54.43 110.276 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -70.31 -13.02 61.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.899 -0.592 . . . . 72.32 111.02 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.589 HG21 ' HD2' ' A' ' 65' ' ' HIS . 39.3 p -110.6 -16.16 13.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.267 -0.424 . . . . 64.2 111.259 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.667 ' HD3' HG21 ' A' ' 144' ' ' VAL . 10.9 mtmm 57.41 29.95 17.79 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.784 0.326 . . . . 73.32 111.043 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.1 mtt85 -95.1 44.07 1.09 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 71.43 110.993 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.433 ' CD2' ' HD2' ' A' ' 6' ' ' PRO . 61.5 m-85 -66.29 174.63 2.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 71.14 110.758 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -69.25 113.02 6.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.293 -0.412 . . . . 75.34 110.856 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -102.92 -179.44 26.51 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.722 -0.752 . . . . 75.12 112.478 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 40.9 p -84.77 140.27 31.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.862 0.363 . . . . 70.11 110.895 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -152.56 117.01 4.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 51.21 110.893 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 5.5 t 61.35 154.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 72.3 110.893 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 4.7 mt -117.6 114.31 45.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.446 . . . . 64.43 111.111 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.73 164.9 16.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 72.25 110.936 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 28.6 tttt -107.11 147.05 30.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 64.41 110.899 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 12.9 m -84.92 -31.88 7.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 71.32 111.118 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.9 m -80.4 172.62 13.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 63.33 110.904 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -177.6 -39.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 63.34 110.964 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -97.38 -32.86 11.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.103 -0.499 . . . . 65.21 110.905 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.536 HG13 ' O ' ' A' ' 85' ' ' VAL . 11.2 p -138.36 116.38 12.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.449 . . . . 73.41 111.082 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.6 145.54 43.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.431 . . . . 63.25 110.913 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -130.49 117.66 19.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 71.32 110.873 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.561 ' O ' HG13 ' A' ' 88' ' ' VAL . 11.1 p -159.04 113.27 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 65.43 111.075 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.28 81.37 0.18 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 71.43 110.878 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.3 mt -148.86 157.03 43.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 61.35 110.918 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -83.31 -31.88 26.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 74.44 110.931 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -86.65 145.52 26.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 63.04 110.931 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -140.87 133.83 29.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 73.32 110.913 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -147.5 149.25 33.65 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 45.14 110.901 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.5 130.95 19.25 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.548 2.165 . . . . 61.35 112.341 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? -110.94 -33.71 6.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 71.41 110.92 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -177.13 -39.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 72.31 110.905 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.1 m 60.42 158.41 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.091 -0.504 . . . . 71.23 110.917 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.2 mmtp -109.31 -32.47 7.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 75.11 110.884 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.3 m -164.46 144.29 7.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 52.24 110.896 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -141.35 96.32 2.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.162 -0.472 . . . . 71.23 110.868 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -98.53 -68.33 0.81 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 73.14 110.882 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.3 m 60.22 158.71 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.982 -0.553 . . . . 61.31 110.949 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tp -111.13 145.93 37.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 62.45 110.884 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -174.88 -40.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 73.15 110.915 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -75.74 -31.54 59.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.112 -0.495 . . . . 74.52 110.921 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 74.76 56.95 4.7 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.716 -0.754 . . . . 61.24 112.488 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.07 176.17 7.37 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.583 2.189 . . . . 65.24 112.283 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.438 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 44.0 Cg_exo -56.7 -162.62 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.637 2.225 . . . . 75.15 112.268 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -98.25 29.07 3.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 54.33 110.97 -179.997 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.438 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 6.2 p90 -160.99 -171.89 3.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 74.2 110.809 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 18.7 m -156.44 103.71 2.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 75.41 111.282 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.491 ' HD2' ' HB1' ' A' ' 178' ' ' ALA . 15.3 tttt -100.45 150.99 22.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.202 -0.454 . . . . 72.22 110.66 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.401 ' O ' HD22 ' A' ' 116' ' ' LEU . 65.6 m -145.49 123.11 11.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.35 -0.386 . . . . 72.43 111.037 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 32.7 t -80.77 106.36 11.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 50.31 111.187 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.533 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.1 mm? -82.27 -41.56 20.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.448 . . . . 74.1 110.683 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 8.3 tptt -125.29 108.08 11.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 73.45 110.825 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.0 mtmp? -62.1 139.27 58.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 63.41 110.945 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -110.96 -158.48 15.54 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.719 -0.753 . . . . 70.4 112.408 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -35.88 -49.21 0.61 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.913 0.387 . . . . 75.32 111.708 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.553 ' O ' HG23 ' A' ' 122' ' ' THR . 1.2 tmtt? 72.89 37.71 0.79 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.994 -0.548 . . . . 73.24 110.298 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.553 HG23 ' O ' ' A' ' 121' ' ' LYS . 0.8 OUTLIER -164.43 -44.05 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.729 -0.669 . . . . 63.21 110.55 179.874 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -84.82 91.7 8.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.066 -0.515 . . . . 71.25 110.671 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -108.89 154.98 41.55 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.466 . . . . 72.42 110.885 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.611 ' HB2' HG21 ' A' ' 166' ' ' VAL . 62.8 Cg_endo -73.58 125.63 10.23 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.546 2.164 . . . . 74.13 112.407 -179.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.07 157.37 15.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 71.01 110.891 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.0 115.36 3.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 62.41 110.958 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 108.02 -24.02 24.11 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.732 -0.747 . . . . 71.15 112.568 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -84.54 135.27 34.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 63.13 110.797 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.687 HG12 ' HG3' ' A' ' 165' ' ' LYS . 22.7 m -68.21 171.69 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.29 -0.414 . . . . 70.31 111.191 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.907 HG22 ' O ' ' A' ' 164' ' ' PHE . 10.9 m -156.13 145.31 12.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.863 -0.608 . . . . 73.54 110.593 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.437 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.3 OUTLIER -127.6 117.59 22.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.702 0.286 . . . . 75.21 110.818 179.595 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.654 ' HB3' HD22 ' A' ' 220' ' ' LEU . 30.1 p -153.47 169.09 24.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.965 0.412 . . . . 64.15 111.085 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.554 ' HB3' HD11 ' A' ' 149' ' ' ILE . 39.5 m95 -102.5 160.51 14.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.94 -0.573 . . . . 55.4 110.102 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.434 ' CD1' ' N ' ' A' ' 135' ' ' TYR . 3.2 p90 -158.84 134.7 8.87 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.734 -0.386 . . . . 73.44 111.591 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' THR . . . . . 1.037 HG21 HG11 ' A' ' 5' ' ' VAL . 57.0 m -127.63 112.5 14.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.958 -0.564 . . . . 62.44 110.553 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.643 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.55 143.84 16.81 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.601 -0.809 . . . . 24.1 113.197 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.739 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -151.58 131.01 12.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.724 0.297 . . . . 75.54 110.384 179.717 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.589 HD21 HD12 ' A' ' 208' ' ' ILE . 83.2 mt -59.24 -178.74 0.06 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.399 -0.364 . . . . 52.14 110.951 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -55.24 -40.9 71.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 65.11 110.852 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.56 0.67 41.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.012 -0.54 . . . . 72.21 111.476 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.75 25.82 26.46 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.612 -0.804 . . . . 63.54 112.64 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' THR . . . . . 0.563 ' HB ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -81.17 108.67 15.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.778 0.323 . . . . 73.42 110.873 179.997 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.667 HG21 ' HD3' ' A' ' 70' ' ' LYS . 27.5 t -65.89 124.46 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.449 . . . . 74.12 111.161 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.823 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 17.7 p90 -111.49 -28.41 8.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 71.32 111.013 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -161.19 115.33 2.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.31 -0.405 . . . . 62.12 111.007 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.608 HG22 ' H ' ' A' ' 149' ' ' ILE . 55.1 m -125.36 116.41 21.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 53.14 110.891 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -86.12 14.65 6.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.921 -0.581 . . . . 55.54 111.636 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.608 ' H ' HG22 ' A' ' 147' ' ' THR . 14.8 mt -124.08 122.78 65.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.767 0.318 . . . . 65.11 111.429 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -142.07 -66.67 0.4 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.302 -0.408 . . . . 75.31 111.03 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.59 163.86 12.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.292 -0.413 . . . . 65.32 110.987 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.3 m -116.06 150.41 37.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 73.31 110.814 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.89 71.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 73.11 111.13 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -74.05 -31.46 62.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 71.15 110.911 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -84.61 -34.62 23.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 75.04 110.896 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -177.29 143.55 0.38 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 75.35 110.874 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 25.2 mttm -74.43 76.72 1.91 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 71.14 110.869 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -154.4 40.38 0.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 73.42 110.823 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.2 120.05 3.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.113 -0.494 . . . . 31.34 111.036 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.3 mmtm -138.97 145.94 47.61 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.304 -0.407 . . . . 60.23 110.875 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.09 147.92 61.8 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.492 2.128 . . . . 70.14 112.339 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.527 HD23 ' C ' ' A' ' 162' ' ' LEU . 3.9 tt -69.38 124.72 24.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 75.4 110.682 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.664 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.29 119.64 38.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.862 0.363 . . . . 53.42 111.081 179.803 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.907 ' O ' HG22 ' A' ' 131' ' ' VAL . 5.3 p90 -149.39 140.82 23.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 70.14 110.855 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.687 ' HG3' HG12 ' A' ' 130' ' ' VAL . 75.8 mttt -78.69 139.51 38.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.009 0.433 . . . . 52.31 110.925 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.611 HG21 ' HB2' ' A' ' 125' ' ' PRO . 29.6 m -87.97 148.91 4.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.874 -0.603 . . . . 53.52 111.373 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.1 24.63 74.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.885 -0.674 . . . . 52.42 112.875 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.721 HG23 ' HG3' ' A' ' 170' ' ' LYS . 5.3 m -129.1 42.67 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.821 0.343 . . . . 52.11 111.101 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 41.8 35.45 1.51 Allowed Glycine 0 C--N 1.332 0.33 0 CA-C-N 116.046 -0.525 . . . . 72.23 113.319 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 170' ' ' LYS . . . . . 0.721 ' HG3' HG23 ' A' ' 168' ' ' VAL . 6.1 mtpp -86.24 -43.65 12.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.814 0.34 . . . . 75.41 111.163 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 5.7 m -115.24 178.17 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.195 -0.457 . . . . 75.23 110.988 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.553 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.92 160.91 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.317 -0.401 . . . . 63.2 111.192 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 3.6 ttp-105 -67.81 -29.05 68.12 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.235 -0.438 . . . . 74.23 111.044 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.9 -37.19 44.9 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.659 -0.781 . . . . 65.14 112.081 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.718 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.0 t90 -78.73 -33.99 46.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.973 0.416 . . . . 74.33 110.983 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 176' ' ' ASP . . . . . 0.775 ' O ' HD13 ' A' ' 180' ' ' LEU . 4.1 t70 -63.87 -33.87 76.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.872 -0.604 . . . . 62.43 110.497 179.722 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -78.73 -29.42 45.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.016 -0.538 . . . . 72.0 110.706 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.629 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -80.0 -56.11 4.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 61.24 111.126 179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.667 HD21 ' NE1' ' A' ' 175' ' ' TRP . 12.5 mt -61.65 -18.96 61.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.899 -0.592 . . . . 74.45 111.128 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.775 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.5 tp -58.38 -27.15 63.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.357 -0.383 . . . . 63.34 111.26 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 47.8 p -111.52 14.01 21.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.494 -0.321 . . . . 75.11 111.717 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.819 ' SD ' HD23 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -71.57 100.72 2.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.882 0.372 . . . . 74.44 110.691 179.869 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.53 159.46 24.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 75.35 111.255 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.52 116.11 4.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.859 -0.61 . . . . 70.21 111.038 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 79.17 11.84 84.64 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.936 -0.649 . . . . 54.01 113.075 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -87.39 146.31 25.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.963 0.411 . . . . 75.22 111.211 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -119.57 135.71 54.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.003 -0.544 . . . . 71.22 109.928 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -150.11 176.37 10.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.099 0.476 . . . . 63.33 111.9 -179.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 189' ' ' ARG . . . . . 0.404 ' CB ' ' HG2' ' A' ' 217' ' ' GLU . 0.0 OUTLIER -137.43 138.29 39.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.577 -0.738 . . . . 74.21 109.462 178.782 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.661 HD23 ' N ' ' A' ' 190' ' ' LEU . 1.1 pt? -140.15 138.16 35.0 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.281 0.562 . . . . 75.22 112.41 -179.267 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.751 ' HG2' HG23 ' A' ' 215' ' ' THR . 6.7 mt-10 -113.46 112.61 23.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.235 -0.893 . . . . 74.34 109.86 179.036 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.477 HD12 ' CE2' ' A' ' 216' ' ' PHE . 1.9 mp -106.6 147.08 12.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.001 0.429 . . . . 73.33 111.596 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.413 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.1 OUTLIER -77.1 167.17 38.89 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.902 -0.59 . . . . 74.12 110.61 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 194' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 27.8 Cg_endo -62.4 -29.49 79.32 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.464 2.11 . . . . 70.43 112.384 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -66.15 -38.89 89.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.261 -0.427 . . . . 71.15 111.143 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.445 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 18.8 m0 -96.88 36.9 1.35 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.357 -0.383 . . . . 70.43 111.027 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -158.66 -81.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 64.54 110.836 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -106.17 -71.39 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.972 0.415 . . . . 61.54 110.61 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 144.0 -176.0 23.55 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.756 -0.735 . . . . 50.24 112.743 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt -57.36 -35.26 69.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.866 0.365 . . . . 73.31 110.899 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -52.26 62.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 75.13 110.616 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.26 -143.68 15.73 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.878 -0.677 . . . . 74.12 112.559 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.411 ' HA ' ' HD2' ' A' ' 204' ' ' PRO . 0.8 OUTLIER -151.97 91.15 3.75 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.606 0.241 . . . . 63.14 110.595 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 204' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 203' ' ' GLN . 21.5 Cg_endo -61.28 -24.21 78.43 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.548 2.165 . . . . 71.52 112.636 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.69 -42.14 74.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.887 0.375 . . . . 73.15 110.862 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.823 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -99.63 26.69 5.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.031 -0.531 . . . . 63.15 111.325 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.53 32.26 13.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.374 -0.376 . . . . 75.35 111.149 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.589 HD12 HD21 ' A' ' 139' ' ' LEU . 19.1 mm -93.78 111.76 54.07 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 62.34 111.11 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 209' ' ' PRO . . . . . 0.588 ' HG2' ' HB2' ' A' ' 212' ' ' ALA . 53.6 Cg_endo -69.44 171.1 14.71 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.362 2.042 . . . . 63.51 112.217 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.33 120.75 7.92 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.492 2.128 . . . . 61.33 112.223 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 63.15 71.23 0.52 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 72.43 110.766 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 212' ' ' ALA . . . . . 0.588 ' HB2' ' HG2' ' A' ' 209' ' ' PRO . . . -123.09 129.06 50.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 54.05 111.432 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.5 tttt -65.43 139.4 58.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.022 -0.535 . . . . 75.33 110.723 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.87 109.6 15.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.416 -0.356 . . . . 74.32 111.318 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.751 HG23 ' HG2' ' A' ' 191' ' ' GLU . 61.2 m -107.88 141.83 38.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 61.53 110.643 179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.643 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 27.0 p90 -158.42 -178.83 7.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.066 0.46 . . . . 73.23 111.684 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 217' ' ' GLU . . . . . 0.404 ' HG2' ' CB ' ' A' ' 189' ' ' ARG . 3.0 mt-10 -136.86 140.37 42.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.746 -0.661 . . . . 72.4 110.601 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.718 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.4 t -123.93 152.23 29.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.108 0.48 . . . . 63.43 111.913 -178.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -136.64 109.78 7.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.635 -0.711 . . . . 74.32 110.289 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.819 HD23 ' SD ' ' A' ' 182' ' ' MET . 0.2 OUTLIER -69.8 128.7 37.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.401 -0.363 . . . . 62.11 110.776 -179.681 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.42 -32.51 2.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.21 -0.45 . . . . 72.45 111.516 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -169.37 159.78 8.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.866 0.365 . . . . 70.14 111.077 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.675 HD11 HD12 ' A' ' 220' ' ' LEU . 3.4 mp -140.83 110.31 3.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.046 -0.524 . . . . 72.15 111.077 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.421 . . . . 52.52 110.916 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 mtt . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.752 0.31 . . . . 64.34 111.171 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.97 99.67 2.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 54.44 111.186 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.581 ' O ' ' HB2' ' A' ' 4' ' ' ALA . . . -98.31 178.07 5.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 75.52 111.031 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 3' ' ' ALA . . . 165.97 85.61 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.251 -0.432 . . . . 73.31 111.172 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.866 HG11 HG21 ' A' ' 136' ' ' THR . 48.4 t -89.31 110.8 41.29 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.466 -0.334 . . . . 35.11 110.642 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.453 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 87.1 Cg_endo -79.04 136.08 12.78 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.61 2.207 . . . . 45.41 112.582 -179.712 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -78.81 157.44 28.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 74.4 110.882 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.91 95.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 61.45 111.171 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.05 -18.0 63.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.489 . . . . 65.23 111.436 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.637 ' CE2' HD11 ' A' ' 20' ' ' LEU . 1.3 m-90 -137.2 173.74 11.36 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.94 0.4 . . . . 71.52 110.897 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.9 m -115.46 150.17 36.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.976 -0.556 . . . . 74.42 110.642 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.454 HG12 ' HD2' ' A' ' 16' ' ' ARG . 38.5 t -56.66 -31.79 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.917 0.389 . . . . 72.03 110.621 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -77.09 -25.56 52.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.968 -0.56 . . . . 72.21 111.042 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -82.21 -58.09 3.1 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.856 0.36 . . . . 75.33 110.833 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.772 ' HB3' HG22 ' A' ' 60' ' ' VAL . 2.6 mt -50.53 -61.08 2.4 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.196 -0.456 . . . . 63.02 111.004 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.568 ' HG3' HG11 ' A' ' 60' ' ' VAL . 22.3 mtt180 -54.16 -24.0 16.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.092 -0.504 . . . . 74.1 111.207 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.81 176.11 0.22 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.936 0.398 . . . . 60.52 111.115 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -110.3 16.65 21.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.022 -0.536 . . . . 71.52 111.161 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -106.9 -25.62 11.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.564 -0.289 . . . . 74.13 111.068 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.637 HD11 ' CE2' ' A' ' 10' ' ' TRP . 2.5 tt -88.05 112.69 50.95 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.413 -0.358 . . . . 42.42 110.957 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.37 125.46 18.99 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.433 2.088 . . . . 64.32 112.368 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.5 -24.12 66.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.162 -0.472 . . . . 75.22 111.156 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.498 ' HA ' HD12 ' A' ' 26' ' ' ILE . 0.6 OUTLIER -54.0 -40.01 66.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.393 -0.367 . . . . 72.24 111.343 -179.786 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.52 -56.79 5.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.219 -0.446 . . . . 72.02 111.063 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.9 mt -44.82 -31.37 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.88 -0.6 . . . . 75.42 111.446 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.647 HG12 HD21 ' A' ' 59' ' ' LEU . 7.7 mt -76.81 -38.8 30.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.931 0.396 . . . . 75.12 110.98 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -72.92 -24.67 60.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.988 -0.551 . . . . 74.01 111.075 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -71.46 -46.83 58.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.035 0.445 . . . . 74.12 110.812 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.813 HD21 ' HA ' ' A' ' 63' ' ' TYR . 6.4 mt -67.77 -25.03 65.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.838 -0.619 . . . . 72.33 110.994 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -78.55 -24.52 45.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.249 -0.432 . . . . 54.51 111.09 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 10.6 pt-20 -93.92 -41.29 9.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.808 0.337 . . . . 73.03 110.838 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.453 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 35.6 m170 -97.28 16.59 19.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 72.12 110.955 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.95 153.7 23.42 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.795 -0.717 . . . . 72.43 112.507 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.7 p -90.62 152.96 20.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.628 0.252 . . . . 40.04 110.507 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.657 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.1 p-10 -49.32 -57.05 7.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.691 0.281 . . . . 71.21 111.116 -179.828 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.8 t -47.95 -50.68 26.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.009 0.433 . . . . 65.14 110.685 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.458 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 9.0 t80 -53.56 -47.16 70.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.78 -0.646 . . . . 65.12 110.348 179.45 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.451 HD21 ' O ' ' A' ' 29' ' ' LEU . 12.9 mt -66.29 -41.04 90.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.047 -0.524 . . . . 74.12 110.722 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.802 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -48.26 -45.56 34.66 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.028 0.442 . . . . 73.21 110.943 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -58.43 -27.29 64.2 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.722 -0.672 . . . . 73.44 110.78 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -112.74 11.88 19.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.207 -0.451 . . . . 73.12 111.124 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.9 mptt 51.22 33.61 9.9 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.85 0.357 . . . . 44.44 110.907 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.785 HD13 HD13 ' A' ' 29' ' ' LEU . 46.7 mt -91.35 -22.62 20.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.104 -0.498 . . . . 73.24 111.802 -179.396 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.802 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -77.37 157.98 30.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.018 0.437 . . . . 63.23 111.123 -179.73 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.73 -121.21 5.1 Favored Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 115.807 -0.633 . . . . 62.11 112.446 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.867 ' O ' HG23 ' A' ' 50' ' ' VAL . 2.2 t-20 -116.32 116.29 27.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.746 0.308 . . . . 72.14 110.914 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.55 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.74 -55.83 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.24 -0.437 . . . . 63.02 111.413 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -47.61 -37.88 13.45 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.86 -0.609 . . . . 64.41 111.022 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -85.7 -26.08 26.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.022 -0.536 . . . . 65.41 111.089 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.867 HG23 ' O ' ' A' ' 46' ' ' ASN . 23.7 t -81.2 -25.8 10.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 63.21 111.418 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.1 -15.63 63.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.381 -0.372 . . . . 52.41 111.15 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -95.14 -32.96 12.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.235 -0.439 . . . . 73.54 110.86 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -87.94 -29.67 20.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.22 -0.446 . . . . 71.05 111.042 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -96.2 125.55 40.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.301 -0.409 . . . . 63.23 111.1 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -81.2 175.14 10.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 72.2 110.588 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.556 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -57.98 -58.25 9.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.855 0.36 . . . . 75.55 110.552 179.916 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.9 -26.46 68.61 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.075 -0.512 . . . . 65.51 110.584 179.578 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.0 -44.23 97.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.094 0.473 . . . . 74.25 110.441 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.647 HD21 HG12 ' A' ' 26' ' ' ILE . 19.2 mt -71.23 -33.68 70.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.635 -0.711 . . . . 75.45 111.046 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.772 HG22 ' HB3' ' A' ' 15' ' ' LEU . 16.4 t -77.38 -42.2 30.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.295 -0.411 . . . . 75.42 110.802 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.4 m -59.61 -34.6 72.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.866 -0.606 . . . . 73.35 110.634 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.485 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -81.96 -21.5 37.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 65.51 111.074 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.813 ' HA ' HD21 ' A' ' 29' ' ' LEU . 11.0 t80 -82.84 -22.89 33.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 74.32 111.029 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -84.37 -53.74 5.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.331 -0.395 . . . . 75.13 111.507 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.458 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.6 p-80 -61.08 -33.09 72.8 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.125 -0.489 . . . . 72.41 111.257 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.691 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.3 tt -47.64 -40.24 19.22 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.962 0.41 . . . . 71.44 111.258 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.406 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.7 m-85 -77.8 -39.02 45.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.029 -0.532 . . . . 75.43 110.679 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -36.28 81.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.92 -0.582 . . . . 63.24 110.988 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.5 p -93.64 -6.65 45.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 71.34 111.475 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.18 36.45 15.81 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.71 0.29 . . . . 72.13 111.186 179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -93.97 44.07 1.12 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.363 -0.381 . . . . 64.13 110.979 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.401 ' HA ' HD21 ' A' ' 66' ' ' LEU . 87.8 m-85 -65.48 174.65 2.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 74.44 110.822 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.2 tttt -70.07 153.07 43.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.274 -0.421 . . . . 63.13 110.906 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -103.15 -85.8 1.9 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.705 -0.759 . . . . 73.41 112.424 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.5 m -163.97 157.78 18.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.788 0.328 . . . . 73.03 110.848 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -169.03 -42.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 64.34 110.986 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.764 ' O ' HD13 ' A' ' 78' ' ' ILE . 83.6 p -156.07 179.76 8.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.117 -0.492 . . . . 53.31 111.017 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.764 HD13 ' O ' ' A' ' 77' ' ' SER . 24.8 mm -140.8 135.34 33.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 62.5 111.138 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.3 m -93.47 159.78 15.09 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.239 -0.437 . . . . 71.12 110.886 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -162.63 143.58 9.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 74.11 110.862 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.2 m -126.81 173.46 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 62.1 111.159 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.3 t -104.27 105.16 15.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.451 . . . . 60.13 110.858 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -149.98 151.59 33.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 55.41 110.913 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -152.6 144.23 23.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 75.43 110.954 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -131.7 127.37 58.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 74.14 111.138 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -129.03 -60.89 1.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 62.23 110.891 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -145.71 118.69 8.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 71.32 110.899 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.81 152.55 26.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 72.22 111.109 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.5 tptt -91.23 -33.06 15.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.206 -0.452 . . . . 74.03 110.866 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.5 tp 60.31 102.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.453 . . . . 71.1 110.886 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -106.08 -32.87 8.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 64.34 110.871 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -133.3 152.58 51.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 73.43 110.883 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -98.76 134.89 41.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 63.31 110.9 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 22.8 mtmt -131.76 161.26 63.51 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 73.43 110.926 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -69.89 163.54 37.98 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.553 2.168 . . . . 75.31 112.36 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.51 171.56 4.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 75.41 110.884 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -177.7 -39.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 63.51 110.957 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.0 t -93.44 136.41 33.73 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.09 -0.504 . . . . 54.12 110.895 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.48 147.56 39.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.181 -0.463 . . . . 64.43 110.864 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.4 p -86.33 126.58 34.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 75.23 110.902 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.23 31.52 2.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 71.44 110.91 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -108.36 126.68 53.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 72.11 110.901 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 71.8 p -109.82 143.15 40.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 34.21 110.914 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 7.9 mt -80.05 -179.07 6.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 64.44 110.906 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -112.37 -35.54 5.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 55.25 110.93 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.86 -38.1 3.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.126 -0.488 . . . . 74.11 110.946 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.03 91.7 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.745 -0.74 . . . . 73.04 112.523 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.51 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 32.0 Cg_exo -56.77 -46.07 32.13 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.539 2.16 . . . . 74.54 112.902 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.51 ' CD ' ' N ' ' A' ' 108' ' ' PRO . 90.1 Cg_endo -82.01 -168.12 0.57 Allowed 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 123.007 2.471 . . . . 74.11 112.381 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -140.69 28.82 1.95 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.235 -0.438 . . . . 75.04 110.959 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.485 ' CE2' ' HB2' ' A' ' 178' ' ' ALA . 8.0 p90 -154.34 147.9 25.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.278 -0.419 . . . . 64.31 110.882 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 70.7 m -118.01 103.55 10.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 71.02 110.893 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.61 151.46 21.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.331 -0.395 . . . . 70.43 111.117 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.2 m -143.93 124.96 14.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.114 -0.494 . . . . 73.43 110.761 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.601 ' O ' HG13 ' A' ' 115' ' ' VAL . 10.0 p -82.61 108.62 15.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.234 -0.439 . . . . 74.42 111.193 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -84.55 -47.86 10.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 75.32 110.784 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -117.63 107.9 14.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.177 -0.465 . . . . 73.35 110.949 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -62.15 134.35 56.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 65.21 110.917 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -104.52 -160.99 24.13 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.78 -0.724 . . . . 65.24 112.319 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -34.84 -47.33 0.34 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.917 0.389 . . . . 73.25 111.723 -179.411 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.533 ' O ' HG23 ' A' ' 122' ' ' THR . 0.8 OUTLIER 72.44 37.59 0.9 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.945 -0.57 . . . . 74.24 110.484 -179.764 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.533 HG23 ' O ' ' A' ' 121' ' ' LYS . 0.9 OUTLIER -162.08 -44.05 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.921 -0.581 . . . . 73.51 110.758 179.984 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -85.62 97.28 10.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 60.35 110.889 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -112.27 155.21 43.93 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.101 -0.499 . . . . 74.21 110.819 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.753 ' HB2' HG21 ' A' ' 166' ' ' VAL . 63.0 Cg_endo -73.84 125.52 10.0 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.529 2.152 . . . . 74.22 112.57 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -96.07 160.16 14.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.005 -0.543 . . . . 64.3 110.913 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.74 116.12 2.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.234 -0.439 . . . . 70.11 110.981 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' GLY . . . . . 0.403 ' O ' ' HG2' ' A' ' 165' ' ' LYS . . . 101.08 -28.28 16.74 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.743 -0.742 . . . . 64.43 112.239 -179.678 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.677 ' O ' HG22 ' A' ' 166' ' ' VAL . 3.9 m-20 -71.68 130.96 42.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.703 0.287 . . . . 73.15 110.4 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' ' 224' ' ' ASP . 12.4 m -73.59 176.17 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.072 0.463 . . . . 74.12 111.423 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.646 HG12 HG23 ' A' ' 223' ' ' ILE . 19.9 m -156.99 146.27 11.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.567 -0.742 . . . . 72.13 110.655 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.418 ' ND1' ' HB3' ' A' ' 163' ' ' SER . 0.5 OUTLIER -124.61 117.27 23.91 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.987 -0.285 . . . . 54.43 110.405 179.275 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.58 ' HB3' HD22 ' A' ' 220' ' ' LEU . 29.7 p -155.38 169.96 23.01 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.075 0.464 . . . . 61.51 111.411 -179.061 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.621 ' HB3' HD11 ' A' ' 149' ' ' ILE . 60.7 m95 -102.26 160.45 14.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.735 -0.666 . . . . 72.11 110.234 179.369 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.419 ' OH ' HD13 ' A' ' 162' ' ' LEU . 6.1 p90 -158.25 134.64 9.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.977 0.418 . . . . 71.21 111.59 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.866 HG21 HG11 ' A' ' 5' ' ' VAL . 84.8 m -124.84 108.83 12.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.616 . . . . 74.3 110.174 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.644 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -93.76 143.7 16.67 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.594 -0.812 . . . . 73.32 113.38 -179.205 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.565 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.7 OUTLIER -152.36 134.28 14.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.718 0.294 . . . . 52.42 110.574 179.669 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.438 HD23 HD23 ' A' ' 214' ' ' LEU . 52.9 mt -62.15 -179.73 0.24 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.425 -0.352 . . . . 72.42 110.672 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -54.74 -41.69 70.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.914 0.387 . . . . 64.3 110.836 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -80.68 0.35 34.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.016 -0.538 . . . . 64.03 111.488 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.19 25.85 27.66 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.644 -0.789 . . . . 42.12 112.542 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.8 m -80.77 108.34 14.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.828 0.347 . . . . 64.23 110.943 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 38.3 t -63.81 120.45 10.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 41.14 111.102 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.443 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 21.5 p90 -111.61 -24.43 10.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.222 -0.444 . . . . 70.25 111.104 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -162.18 112.63 1.56 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.799 0.333 . . . . 64.44 111.149 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.485 HG22 ' H ' ' A' ' 149' ' ' ILE . 43.5 m -127.01 113.28 16.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 72.54 110.696 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.51 ' C ' HD12 ' A' ' 149' ' ' ILE . 52.5 t30 -87.1 12.64 11.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 74.53 111.66 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.68 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.5 mp -114.13 119.59 61.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.857 0.361 . . . . 75.21 111.003 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -123.57 -48.47 1.93 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 74.51 110.858 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 29.8 p -146.48 166.0 27.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 73.5 110.954 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.3 m -83.31 166.3 18.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 75.2 110.953 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.06 -47.28 13.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.439 . . . . 63.42 111.071 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.9 tppt? -60.06 -33.08 71.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 73.23 110.943 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 12.4 tttp -76.54 -31.59 57.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.172 -0.467 . . . . 73.12 110.88 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -173.11 166.35 4.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 65.23 110.916 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 28.3 mttt -98.79 31.27 3.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 75.11 110.896 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -101.26 34.46 2.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 72.24 110.853 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.529 ' HB1' ' HH2' ' A' ' 134' ' ' TRP . . . -157.18 118.43 3.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 73.33 111.034 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.1 mttt -132.53 124.32 18.97 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 72.05 110.874 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.401 ' HB2' ' HB3' ' A' ' 132' ' ' HIS . 50.4 Cg_exo -53.98 150.51 30.58 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.493 2.129 . . . . 71.43 112.294 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.419 HD13 ' OH ' ' A' ' 135' ' ' TYR . 0.5 OUTLIER -80.17 128.85 34.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.199 -0.455 . . . . 62.55 110.658 179.909 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.613 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 1.0 OUTLIER -109.45 127.3 54.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.322 -0.399 . . . . 65.55 111.313 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.587 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 25.3 p90 -152.82 143.5 22.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.066 -0.516 . . . . 74.23 110.829 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.603 ' CB ' HG21 ' A' ' 168' ' ' VAL . 2.2 mptt -71.02 132.34 45.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.337 -0.392 . . . . 62.03 110.9 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.753 HG21 ' HB2' ' A' ' 125' ' ' PRO . 33.7 m -87.68 149.26 4.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.142 -0.481 . . . . 64.51 111.06 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.74 24.46 75.47 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.792 -0.718 . . . . 44.4 112.64 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.603 HG21 ' CB ' ' A' ' 165' ' ' LYS . 14.4 m -134.03 46.42 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.845 0.355 . . . . 74.33 111.129 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.28 35.74 2.73 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 121.204 -0.522 . . . . 70.12 113.256 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 170' ' ' LYS . . . . . 0.58 ' HG2' HG23 ' A' ' 168' ' ' VAL . 12.3 mmtt -81.19 -47.03 13.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.897 0.38 . . . . 74.01 110.952 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 171' ' ' VAL . . . . . 0.41 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.3 OUTLIER -118.64 -179.09 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.992 -0.549 . . . . 64.23 110.879 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.57 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.4 pt -57.8 158.85 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.418 -0.355 . . . . 71.12 111.074 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 25.5 ttm105 -67.45 -27.15 66.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.235 -0.439 . . . . 63.23 111.273 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.58 -36.65 37.43 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.679 -0.772 . . . . 70.21 112.188 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.726 ' HE1' HG21 ' A' ' 218' ' ' VAL . 1.9 t90 -77.86 -33.68 52.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.954 0.407 . . . . 72.0 111.014 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -62.27 -41.54 98.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.964 -0.562 . . . . 72.53 110.308 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.94 -29.78 65.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.9 -0.591 . . . . 71.43 110.547 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.646 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -78.7 -61.65 1.94 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 71.41 111.246 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.717 HD21 ' NE1' ' A' ' 175' ' ' TRP . 15.1 mt -58.9 -20.44 51.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.978 -0.556 . . . . 73.41 111.23 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 4.1 mt -60.37 -27.21 67.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.774 0.321 . . . . 73.43 110.883 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 69.9 p -107.78 10.27 28.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 73.41 111.598 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.757 ' SD ' HD23 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -73.35 99.41 2.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.87 0.367 . . . . 63.14 110.848 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.17 161.46 19.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 75.32 111.169 -179.557 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 184' ' ' LYS . . . . . 0.439 ' HG3' HD12 ' A' ' 223' ' ' ILE . 10.8 tttt -59.88 114.99 3.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.827 -0.624 . . . . 72.41 111.227 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 81.3 8.62 86.97 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.961 -0.638 . . . . 72.33 113.126 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -85.4 139.7 31.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.028 0.442 . . . . 74.1 111.404 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -117.08 139.28 50.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.861 -0.609 . . . . 71.41 109.927 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -148.01 175.39 11.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 33.15 112.061 -179.497 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.63 121.39 17.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.41 -0.813 . . . . 65.12 109.56 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.646 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.5 pt? -134.36 143.42 47.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.346 0.593 . . . . 50.01 112.351 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.878 ' HG2' HG23 ' A' ' 215' ' ' THR . 4.2 mt-10 -114.87 117.42 30.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.135 -0.939 . . . . 71.44 109.945 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.499 HD12 ' CE2' ' A' ' 216' ' ' PHE . 2.2 mt -108.28 137.15 41.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.972 0.415 . . . . 71.02 111.495 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.63 164.94 45.89 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 70.35 110.57 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 194' ' ' PRO . . . . . 0.464 ' HG3' ' HA ' ' A' ' 211' ' ' ASN . 19.4 Cg_endo -59.03 -35.24 98.79 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.568 2.179 . . . . 54.45 112.226 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -56.54 -43.53 79.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 45.1 111.411 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.446 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 12.5 m0 -96.64 34.96 1.57 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.884 0.373 . . . . 63.02 111.169 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -159.38 -78.78 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.004 -0.544 . . . . 63.02 110.727 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 198' ' ' TYR . . . . . 0.578 ' CE2' HD13 ' A' ' 208' ' ' ILE . 47.1 m-85 -105.47 -71.28 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.0 0.429 . . . . 64.33 110.401 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.23 178.4 16.43 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.763 -0.732 . . . . 53.41 112.953 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -56.98 -31.7 65.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.811 0.339 . . . . 71.3 110.803 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -53.3 58.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.464 . . . . 75.23 110.609 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 107.61 -147.3 16.35 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.845 -0.693 . . . . 62.42 112.518 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.802 ' CB ' HD12 ' A' ' 208' ' ' ILE . 0.0 OUTLIER -156.61 82.9 3.29 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.779 0.323 . . . . 63.35 110.656 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -51.13 -35.7 52.66 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.749 2.3 . . . . 63.53 112.638 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.7 -42.1 83.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.855 0.359 . . . . 74.45 111.009 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.501 ' HB3' HG13 ' A' ' 208' ' ' ILE . . . -101.77 27.17 6.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.052 -0.522 . . . . 74.35 111.361 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 51.7 31.04 7.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.366 -0.379 . . . . 74.14 111.09 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.802 HD12 ' CB ' ' A' ' 203' ' ' GLN . 24.5 mt -89.17 111.71 46.77 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 51.23 111.181 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 209' ' ' PRO . . . . . 0.549 ' O ' ' HB2' ' A' ' 212' ' ' ALA . 70.6 Cg_endo -74.5 164.85 33.0 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.451 2.101 . . . . 71.32 112.397 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.99 147.89 50.36 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.651 2.234 . . . . 73.12 112.347 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 211' ' ' ASN . . . . . 0.464 ' HA ' ' HG3' ' A' ' 194' ' ' PRO . 70.7 m-80 51.13 36.22 15.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 73.12 111.03 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 212' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 209' ' ' PRO . . . -82.58 142.14 32.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 43.32 111.978 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -97.24 159.2 15.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.677 -0.692 . . . . 62.43 109.873 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.543 HD11 ' CD2' ' A' ' 198' ' ' TYR . 3.0 mt -134.39 108.99 8.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.988 0.423 . . . . 74.43 111.951 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.878 HG23 ' HG2' ' A' ' 191' ' ' GLU . 25.5 m -103.06 139.68 38.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.873 -0.603 . . . . 75.02 110.449 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.644 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 12.4 p90 -158.75 179.27 9.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.097 0.475 . . . . 70.11 111.894 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -136.67 140.32 42.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.543 -0.753 . . . . 71.14 110.593 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.726 HG21 ' HE1' ' A' ' 175' ' ' TRP . 4.4 t -124.12 151.8 29.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.087 0.47 . . . . 62.25 111.986 -178.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.427 ' O ' ' HB2' ' A' ' 133' ' ' CYS . 25.4 tt0 -135.97 109.21 7.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.608 -0.724 . . . . 73.02 110.106 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.757 HD23 ' SD ' ' A' ' 182' ' ' MET . 0.2 OUTLIER -69.71 127.89 34.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.313 -0.403 . . . . 71.04 110.936 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 22.0 t -109.06 -29.46 2.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.167 -0.469 . . . . 63.13 111.33 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -169.59 160.34 8.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.412 -0.358 . . . . 64.25 110.916 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.646 HG23 HG12 ' A' ' 131' ' ' VAL . 3.4 mp -139.24 110.17 4.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 62.14 111.106 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 224' ' ' ASP . . . . . 0.563 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 73.04 110.892 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 mtt . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.856 0.36 . . . . 71.34 111.211 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -108.3 136.93 47.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 75.22 111.121 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -95.24 78.24 3.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 73.0 111.103 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -74.74 170.29 16.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 73.34 111.08 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.957 HG11 HG21 ' A' ' 136' ' ' THR . 24.0 t -65.24 111.77 6.78 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 65.24 111.165 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.449 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.5 Cg_endo -78.4 137.61 15.02 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.608 2.206 . . . . 71.33 112.419 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.402 ' O ' ' N ' ' A' ' 9' ' ' ALA . 7.6 mm-40 -80.2 154.72 27.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.246 -0.433 . . . . 71.41 110.852 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.543 HH11 HD12 ' A' ' 149' ' ' ILE . 0.0 OUTLIER -52.34 89.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.107 -0.497 . . . . 72.45 111.373 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.402 ' N ' ' O ' ' A' ' 7' ' ' GLN . . . -60.69 -34.55 74.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 73.04 111.056 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.427 ' CE2' HD11 ' A' ' 20' ' ' LEU . 1.5 m-90 -116.09 173.74 6.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.489 . . . . 72.53 110.965 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.3 m -116.25 152.18 34.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.944 -0.571 . . . . 41.41 110.535 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.55 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.9 t -56.6 -33.64 40.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.912 0.386 . . . . 62.51 110.854 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -74.13 -25.7 59.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.989 -0.55 . . . . 74.21 111.181 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -82.12 -56.91 3.65 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.806 0.336 . . . . 73.44 110.994 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.69 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.2 mt -49.6 -63.73 1.02 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.258 -0.428 . . . . 61.33 111.116 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.552 ' HG3' HG11 ' A' ' 60' ' ' VAL . 22.5 mtt180 -53.92 -24.72 17.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.484 . . . . 73.43 111.187 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.17 178.23 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.034 0.445 . . . . 72.11 111.256 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -110.41 17.05 21.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.827 -0.624 . . . . 72.22 111.179 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.67 -24.89 11.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.588 -0.278 . . . . 73.44 111.231 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.523 HD22 HD11 ' A' ' 25' ' ' ILE . 6.2 tt -89.07 116.27 65.88 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.414 -0.357 . . . . 74.44 111.054 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.29 124.41 15.81 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.437 2.091 . . . . 60.33 112.235 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.458 ' O ' HD12 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -60.77 -24.18 65.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 64.14 111.206 -179.942 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -57.75 -32.97 67.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.388 -0.369 . . . . 73.24 111.335 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -78.87 -53.07 7.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.923 0.392 . . . . 62.14 111.133 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.673 ' O ' HD12 ' A' ' 29' ' ' LEU . 34.9 mt -46.54 -35.66 2.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.899 -0.592 . . . . 63.31 111.411 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.692 ' HB ' HG23 ' A' ' 47' ' ' ILE . 6.2 mt -75.74 -44.72 39.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 63.13 111.012 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.78 -25.18 64.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.01 -0.541 . . . . 72.35 110.925 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 38.3 t80 -70.05 -44.01 70.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 74.21 110.65 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.729 HD21 ' HA ' ' A' ' 63' ' ' TYR . 2.5 mt -71.32 -24.21 62.08 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.752 -0.658 . . . . 75.2 110.92 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -76.34 -25.15 54.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.282 -0.417 . . . . 71.23 110.803 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -102.35 -10.51 19.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.236 -0.438 . . . . 72.11 111.095 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 13.1 m170 -117.09 -11.43 10.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.425 -0.352 . . . . 72.22 111.371 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -120.3 164.69 13.8 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.679 -0.772 . . . . 34.43 112.391 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.77 149.58 21.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.599 0.238 . . . . 73.12 110.468 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.594 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -48.51 -57.15 6.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.79 0.328 . . . . 62.35 111.016 -179.82 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.3 p -47.89 -51.67 22.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.909 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.516 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 4.7 t80 -53.48 -46.85 70.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.835 -0.621 . . . . 62.02 110.387 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.512 HD22 ' HB3' ' A' ' 43' ' ' LEU . 13.2 mt -65.34 -41.47 93.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.0 -0.545 . . . . 71.04 110.744 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.852 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -48.11 -43.64 31.21 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.961 0.41 . . . . 54.21 111.034 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -58.87 -27.96 65.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.905 -0.589 . . . . 63.53 110.834 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 39.1 m-70 -112.75 10.28 19.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.155 -0.475 . . . . 71.32 111.169 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.4 mttp 55.24 36.98 28.2 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.89 0.376 . . . . 53.03 110.823 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.555 HD21 HD23 ' A' ' 59' ' ' LEU . 11.7 mt -94.97 -21.84 18.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.109 -0.496 . . . . 72.33 111.898 -179.32 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.852 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -77.24 155.51 32.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.12 0.486 . . . . 73.13 111.201 -179.756 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.27 -123.51 5.89 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.626 -0.715 . . . . 71.11 112.427 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.658 ' O ' HG23 ' A' ' 50' ' ' VAL . 2.4 m-80 -116.38 118.04 31.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.75 0.309 . . . . 61.42 110.986 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.692 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.1 mp -45.16 -52.22 2.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.167 -0.47 . . . . 53.35 111.401 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -47.34 -37.16 10.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.907 -0.588 . . . . 52.12 110.974 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -85.65 -25.67 26.45 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.921 -0.581 . . . . 73.24 111.205 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.658 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.5 t -83.45 -25.94 7.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.384 -0.371 . . . . 73.52 111.453 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.78 -17.93 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.441 -0.345 . . . . 61.54 111.406 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.6 pttp -95.09 -33.8 12.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.829 0.347 . . . . 73.42 110.995 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.5 m -87.38 -31.0 20.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.228 -0.442 . . . . 60.5 111.031 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.68 127.7 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 63.11 111.17 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -83.41 176.77 8.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 73.42 110.683 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.536 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -58.54 -58.25 9.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.869 0.366 . . . . 72.01 110.515 179.918 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.39 -29.49 70.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.141 -0.481 . . . . 74.54 110.308 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -42.22 98.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 74.41 110.435 179.645 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.555 HD23 HD21 ' A' ' 43' ' ' LEU . 71.8 mt -72.03 -35.75 69.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.734 -0.666 . . . . 72.22 110.87 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.69 HG22 ' HB3' ' A' ' 15' ' ' LEU . 17.3 t -75.57 -41.24 41.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.213 -0.449 . . . . 72.21 110.826 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.6 m -60.45 -34.0 73.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.895 -0.593 . . . . 52.44 110.428 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.426 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -80.7 -21.24 41.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 72.53 110.932 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.729 ' HA ' HD21 ' A' ' 29' ' ' LEU . 62.1 t80 -83.86 -22.95 31.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.077 -0.51 . . . . 74.44 111.017 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -84.89 -54.51 4.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.23 -0.441 . . . . 73.34 111.512 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.516 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.4 p-80 -61.31 -26.28 67.68 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.076 -0.511 . . . . 75.03 111.056 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.664 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.7 tt -53.08 -39.81 63.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.938 0.399 . . . . 54.24 110.976 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -78.23 -37.66 44.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.981 -0.554 . . . . 74.2 110.599 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.62 -36.51 78.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.974 -0.557 . . . . 64.13 110.818 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 46.6 p -88.9 -9.82 50.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.033 -0.531 . . . . 73.1 111.454 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 50.5 37.69 16.53 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.754 0.312 . . . . 64.25 111.234 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 37.1 mtt180 -100.3 47.54 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.286 -0.416 . . . . 64.05 110.975 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.434 ' CD2' ' HD2' ' A' ' 6' ' ' PRO . 75.1 m-85 -69.22 178.61 2.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.164 -0.471 . . . . 74.23 110.924 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -76.59 132.02 39.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 55.44 110.749 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 179.91 -84.96 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.647 -0.787 . . . . 72.51 112.479 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 26.8 p -57.13 96.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.82 0.343 . . . . 73.02 110.981 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -176.98 -39.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 51.34 110.88 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 68.8 m -160.8 120.11 2.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.116 -0.493 . . . . 72.44 110.927 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.2 mt -103.81 -30.47 2.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.464 . . . . 60.34 111.148 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.1 m -157.27 -45.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 74.14 110.963 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.1 mtpt 61.32 113.82 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.997 -0.547 . . . . 65.43 110.92 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.4 m -123.71 114.58 42.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.457 . . . . 55.24 111.091 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.529 ' HB3' HG23 ' A' ' 85' ' ' VAL . 37.0 m -92.57 172.38 8.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 73.23 110.874 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -107.9 -33.02 7.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 52.52 110.928 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -164.31 96.31 0.77 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 65.13 110.886 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.529 HG23 ' HB3' ' A' ' 82' ' ' SER . 21.6 t -131.12 113.24 23.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 52.33 111.146 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.42 120.68 13.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 52.51 110.921 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -137.94 29.38 2.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 64.44 110.957 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 20.8 t 68.79 -67.99 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.25 -0.432 . . . . 73.11 111.285 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -64.57 98.09 0.24 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.982 -0.554 . . . . 73.02 110.939 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.605 HD23 ' H ' ' A' ' 92' ' ' GLU . 0.5 OUTLIER 61.79 152.02 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 75.33 110.933 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.424 ' N ' HD23 ' A' ' 90' ' ' LEU . 20.2 p-10 -112.78 -34.61 5.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 65.32 110.927 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.605 ' H ' HD23 ' A' ' 90' ' ' LEU . 1.2 tt0 60.4 100.75 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 65.41 110.858 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -111.57 -33.22 6.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.448 . . . . 64.52 110.979 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.4 mmtt -93.49 143.03 25.98 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 62.04 110.939 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.32 132.42 50.63 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.501 2.134 . . . . 64.21 112.269 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -177.21 116.06 0.1 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.464 . . . . 63.42 110.89 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -151.25 130.38 12.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 63.11 110.917 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.47 HG23 ' O ' ' A' ' 98' ' ' THR . 8.8 t -150.6 110.32 4.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.175 -0.466 . . . . 74.41 110.882 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.34 137.72 44.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 65.32 110.918 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 43.0 m -140.45 163.64 32.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 41.15 110.919 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.64 106.36 7.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 63.01 110.937 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -160.58 124.57 3.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 73.31 110.899 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 53.8 p -157.5 137.33 12.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 75.13 110.871 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 tt 61.26 113.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 54.24 110.965 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.6 -33.21 11.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 73.43 110.924 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -95.6 89.92 5.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 74.04 110.876 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -127.6 92.5 0.36 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.739 -0.743 . . . . 74.55 112.482 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.513 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 32.1 Cg_exo -56.58 -45.95 33.39 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.54 2.16 . . . . 75.12 112.904 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.513 ' CD ' ' N ' ' A' ' 108' ' ' PRO . 89.5 Cg_endo -81.99 -168.09 0.57 Allowed 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 123.019 2.479 . . . . 75.43 112.389 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.436 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -131.46 30.24 4.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 74.43 110.936 -180.0 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.511 ' CE2' ' HB2' ' A' ' 178' ' ' ALA . 41.4 p90 -151.59 155.08 37.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.273 -0.421 . . . . 61.23 110.931 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 71.5 m -122.88 103.5 8.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.161 -0.472 . . . . 71.21 110.845 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.508 ' CE ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -89.48 151.38 22.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.275 -0.421 . . . . 63.4 111.125 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.426 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.9 OUTLIER -144.89 112.83 6.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 54.25 110.837 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.508 HG22 ' CE ' ' A' ' 113' ' ' LYS . 19.5 t -81.94 106.36 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 72.24 111.29 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.556 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.0 mm? -83.21 -41.81 17.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 72.22 110.844 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 4.6 tptt -128.44 108.13 10.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 73.12 110.984 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -59.44 144.67 46.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 72.02 110.966 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.513 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -115.66 -156.55 11.03 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.721 -0.752 . . . . 52.5 112.642 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -35.84 -52.32 0.72 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.022 0.439 . . . . 62.33 111.576 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.9 tttp 69.9 33.47 2.82 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.834 -0.621 . . . . 64.11 110.325 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -152.33 -44.57 0.1 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.796 -0.638 . . . . 64.21 110.651 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' ASN . . . . . 0.401 ' HB2' ' HB2' ' A' ' 184' ' ' LYS . 13.7 m120 -91.01 98.41 11.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 74.31 110.841 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -108.08 157.16 36.91 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 71.42 110.913 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.636 ' HA ' HG21 ' A' ' 223' ' ' ILE . 58.7 Cg_endo -71.93 125.83 11.34 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.577 2.185 . . . . 63.24 112.407 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -96.88 155.08 16.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 74.44 110.889 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -62.69 117.12 5.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 70.42 110.861 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 104.78 -22.96 32.43 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.612 -0.804 . . . . 74.34 112.647 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -85.95 140.17 30.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.756 0.312 . . . . 65.2 110.818 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.698 HG12 ' HG3' ' A' ' 165' ' ' LYS . 22.2 m -69.09 173.24 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.971 0.415 . . . . 71.43 111.328 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.901 HG22 ' O ' ' A' ' 164' ' ' PHE . 15.9 m -156.89 145.77 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.717 -0.674 . . . . 62.53 110.588 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.461 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.95 117.89 22.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.659 0.266 . . . . 75.01 110.665 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.434 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 25.1 p -150.28 173.92 13.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.118 0.485 . . . . 71.32 111.407 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.842 ' HB3' HD11 ' A' ' 149' ' ' ILE . 87.5 m95 -108.25 157.58 18.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.552 -0.749 . . . . 72.35 110.057 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.478 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 40.3 p90 -162.23 138.37 7.67 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.223 0.535 . . . . 64.42 112.145 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.957 HG21 HG11 ' A' ' 5' ' ' VAL . 12.3 m -129.69 114.57 16.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.426 -0.806 . . . . 71.04 110.151 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.619 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.06 146.01 18.11 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.544 -0.836 . . . . 54.52 113.328 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.747 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -151.22 147.8 27.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.816 0.341 . . . . 73.2 110.766 179.711 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.484 ' HA ' HD23 ' A' ' 139' ' ' LEU . 12.6 mt -81.72 -177.18 6.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 63.3 110.851 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -59.66 -43.1 94.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.45 . . . . 74.02 110.885 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.04 -5.73 56.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.981 -0.554 . . . . 72.44 111.357 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 98.44 25.42 10.11 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.7 -0.762 . . . . 34.22 112.648 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.08 109.65 20.69 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.827 0.346 . . . . 71.01 110.761 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.498 HG12 HG23 ' A' ' 138' ' ' THR . 3.0 m -63.69 135.1 28.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.446 . . . . 63.32 111.296 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.437 ' CD1' ' N ' ' A' ' 146' ' ' ASP . 21.0 p90 -116.85 -40.99 3.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.094 -0.503 . . . . 53.24 110.643 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 146' ' ' ASP . . . . . 0.437 ' N ' ' CD1' ' A' ' 145' ' ' PHE . 70.6 m-20 -143.65 110.3 5.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.914 -0.584 . . . . 60.0 110.374 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.427 ' CG2' HG23 ' A' ' 136' ' ' THR . 25.0 m -134.1 107.72 7.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.941 0.401 . . . . 73.23 111.455 -179.462 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.478 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 27.8 t30 -90.32 44.3 1.19 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.958 -0.565 . . . . 70.14 110.21 179.281 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.842 HD11 ' HB3' ' A' ' 134' ' ' TRP . 35.5 mm -122.92 105.39 15.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 61.12 110.893 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -95.73 -77.92 0.47 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 71.21 110.938 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 48.6 p -146.49 166.03 27.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 61.33 110.937 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 40.4 m -78.24 139.09 38.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.224 -0.444 . . . . 62.0 110.886 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -67.61 -30.89 70.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.227 -0.442 . . . . 63.41 111.122 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.25 -33.1 71.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 74.24 110.912 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.07 -63.1 1.5 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 72.43 110.943 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 13.0 tttm -138.53 135.57 35.2 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.881 -0.599 . . . . 75.44 110.931 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 8.6 mttm -69.15 93.92 0.64 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.441 . . . . 65.34 110.934 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -176.49 46.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 71.05 110.85 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.09 125.8 5.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 50.04 111.075 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 13.5 mmtt -140.8 145.97 42.12 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 65.53 110.897 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -69.71 152.93 69.68 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.549 2.166 . . . . 51.42 112.31 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.442 HD23 ' HD1' ' A' ' 164' ' ' PHE . 2.0 tt -73.67 123.09 23.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 74.44 110.48 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.682 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.39 120.83 40.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.939 0.4 . . . . 75.43 111.266 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.901 ' O ' HG22 ' A' ' 131' ' ' VAL . 13.9 p90 -149.67 141.13 23.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.029 -0.532 . . . . 74.44 110.786 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.698 ' HG3' HG12 ' A' ' 130' ' ' VAL . 28.2 mtmt -77.34 138.17 39.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.958 0.409 . . . . 72.1 110.895 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.602 HG21 ' HB2' ' A' ' 125' ' ' PRO . 29.8 m -87.5 148.92 4.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.945 -0.57 . . . . 71.45 111.051 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 66.01 25.59 72.11 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.688 -0.768 . . . . 73.23 112.098 -179.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.56 HG21 ' HB3' ' A' ' 165' ' ' LYS . 1.9 t -130.98 40.98 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.843 0.354 . . . . 74.31 111.016 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.54 35.18 5.38 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 121.05 -0.595 . . . . 72.41 112.966 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.31 -47.05 11.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.906 0.384 . . . . 73.05 111.064 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.3 m -117.48 179.73 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.095 -0.502 . . . . 73.21 111.058 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.527 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -59.95 160.11 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.332 -0.394 . . . . 61.42 111.12 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -68.04 -28.89 67.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.264 -0.426 . . . . 74.01 111.193 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.83 -37.82 43.6 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.64 -0.79 . . . . 74.14 111.943 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.716 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.3 t90 -79.03 -34.06 44.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.043 0.449 . . . . 65.41 110.964 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 176' ' ' ASP . . . . . 0.645 ' O ' HD13 ' A' ' 180' ' ' LEU . 36.0 t70 -65.16 -31.16 72.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.756 -0.656 . . . . 74.12 110.602 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -82.0 -28.53 32.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 75.14 110.833 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.628 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -80.32 -62.01 1.81 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.226 -0.443 . . . . 61.31 111.168 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.675 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 6.4 mt -50.29 -32.56 17.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.972 -0.558 . . . . 65.51 110.824 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.645 HD13 ' O ' ' A' ' 176' ' ' ASP . 0.3 OUTLIER -54.54 -24.58 21.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.138 -0.483 . . . . 71.13 110.957 179.734 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 24.9 p -97.54 1.84 49.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.253 -0.431 . . . . 62.4 111.707 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.567 ' HE1' ' O ' ' A' ' 218' ' ' VAL . 0.0 OUTLIER -79.68 152.77 29.75 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.765 0.316 . . . . 64.41 110.565 179.773 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 10.3 p -120.94 173.07 7.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.977 0.418 . . . . 74.5 111.505 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 184' ' ' LYS . . . . . 0.596 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -64.61 117.4 7.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.808 -0.633 . . . . 74.05 110.574 179.721 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.43 66.46 2.24 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.614 -0.803 . . . . 44.14 112.085 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 186' ' ' GLU . . . . . 0.513 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 30.9 tt0 -145.05 144.4 30.96 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.623 0.249 . . . . 74.54 110.461 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -119.26 137.24 53.8 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.204 -0.295 . . . . 63.13 110.204 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -144.26 173.1 12.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.149 0.499 . . . . 75.03 111.865 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.57 101.14 4.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.527 -0.761 . . . . 52.44 109.752 179.413 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.807 HD12 HD11 ' A' ' 192' ' ' ILE . 1.0 OUTLIER -115.61 142.26 46.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.123 0.487 . . . . 64.44 111.947 -178.827 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.854 ' HB3' HG23 ' A' ' 215' ' ' THR . 4.8 pt-20 -114.14 119.28 36.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.651 -0.704 . . . . 74.25 110.207 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.807 HD11 HD12 ' A' ' 190' ' ' LEU . 1.8 mm -99.51 143.93 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.858 0.361 . . . . 65.23 111.262 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.42 165.4 46.54 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.075 -0.512 . . . . 71.41 110.602 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -64.51 -43.57 13.32 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.486 2.124 . . . . 72.14 112.264 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -54.67 -24.28 21.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 63.31 111.304 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.436 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 8.5 m0 -115.93 36.94 3.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.404 -0.362 . . . . 75.24 111.122 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -156.67 -81.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.259 -0.428 . . . . 61.42 111.363 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 198' ' ' TYR . . . . . 0.771 ' CE2' HD13 ' A' ' 208' ' ' ILE . 17.2 m-85 -104.76 -31.19 9.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.899 0.381 . . . . 70.23 110.937 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 107.25 168.42 22.09 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.747 -0.74 . . . . 52.13 112.575 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -30.62 67.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.846 0.355 . . . . 72.11 110.896 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 6.8 pttt -59.91 -48.12 83.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.245 -0.434 . . . . 71.52 110.754 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.68 161.78 24.08 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.801 -0.714 . . . . 74.32 112.467 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.783 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.3 OUTLIER -105.77 89.1 3.27 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 120.65 0.262 . . . . 74.52 110.809 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.37 -22.25 52.83 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.502 2.134 . . . . 64.51 112.369 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.3 -40.51 82.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.304 -0.407 . . . . 62.3 110.923 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -109.26 27.13 9.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 73.44 111.254 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 11.0 tttt 56.84 54.4 7.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.249 -0.432 . . . . 74.31 111.044 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.783 HD12 ' HB3' ' A' ' 203' ' ' GLN . 42.4 mt -118.36 111.68 38.13 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 74.42 111.125 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.37 172.54 1.86 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.516 2.144 . . . . 75.23 112.309 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.2 127.53 12.09 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.583 2.188 . . . . 71.13 112.332 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 30.3 m-20 63.9 71.23 0.49 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.277 -0.419 . . . . 62.43 110.852 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.84 128.59 49.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 54.43 111.248 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -65.59 141.37 58.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.477 . . . . 65.11 110.735 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.593 HD11 ' CE2' ' A' ' 198' ' ' TYR . 22.8 mt -121.79 109.61 14.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 74.23 111.117 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.854 HG23 ' HB3' ' A' ' 191' ' ' GLU . 0.2 OUTLIER -107.95 136.83 46.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.36 -0.382 . . . . 72.33 110.778 179.911 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.619 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 18.0 p90 -152.92 176.94 11.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.992 0.425 . . . . 74.5 111.268 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -130.92 135.0 47.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.843 -0.617 . . . . 75.22 110.31 179.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.716 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.6 t -120.24 150.13 22.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.076 0.465 . . . . 63.44 112.122 -178.654 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -136.75 107.63 6.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.617 -0.72 . . . . 75.41 110.192 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.596 HD22 ' HA ' ' A' ' 184' ' ' LYS . 3.0 tt -70.37 134.47 47.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.38 -0.373 . . . . 73.53 111.046 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.419 ' N ' HD23 ' A' ' 220' ' ' LEU . 20.9 t -111.3 -29.81 2.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.207 -0.451 . . . . 75.03 111.446 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 222' ' ' ASP . . . . . 0.477 ' N ' HD23 ' A' ' 220' ' ' LEU . 2.0 t0 -173.0 163.87 4.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.855 0.359 . . . . 71.2 111.112 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.682 HG23 HG12 ' A' ' 131' ' ' VAL . 2.7 mp -139.86 110.42 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 73.45 110.984 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 224' ' ' ASP . . . . . 0.559 ' O ' HG22 ' A' ' 130' ' ' VAL . 1.6 m-20 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 74.13 110.836 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.514 ' HB3' HG21 ' A' ' 75' ' ' THR . 2.1 mpt? . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.846 0.355 . . . . 52.11 111.181 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -174.89 89.21 0.05 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 72.5 111.097 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -73.14 86.89 1.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 62.43 111.107 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.29 142.86 41.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 71.4 111.202 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 1.13 HG11 HG21 ' A' ' 136' ' ' THR . 34.9 t -60.17 110.38 2.8 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.177 -0.465 . . . . 72.52 111.112 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.448 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.7 Cg_endo -78.42 142.54 18.75 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.615 2.21 . . . . 41.42 112.512 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.416 ' HB2' ' HB3' ' A' ' 217' ' ' GLU . 7.2 tp60 -83.84 153.48 24.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 71.42 110.833 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.17 110.45 0.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.184 -0.462 . . . . 70.34 111.327 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.56 -18.98 43.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.495 . . . . 64.21 111.2 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.582 ' CD1' HD11 ' A' ' 20' ' ' LEU . 1.4 m-90 -135.01 172.92 12.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.067 0.461 . . . . 62.05 110.761 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.4 m -110.2 148.58 31.56 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.731 -0.668 . . . . 53.15 110.103 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.48 ' O ' ' CG ' ' A' ' 16' ' ' ARG . 58.2 t -56.32 -33.58 38.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.96 0.41 . . . . 74.45 110.211 179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -69.92 -25.74 63.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.803 -0.635 . . . . 72.03 110.791 179.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.417 ' O ' ' HB2' ' A' ' 17' ' ' SER . 0.1 OUTLIER -82.02 -54.9 4.93 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.337 -0.392 . . . . 72.13 111.273 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.795 ' HB3' HG22 ' A' ' 60' ' ' VAL . 4.4 mt -50.0 -66.71 0.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.082 0.401 . . . . 51.5 112.082 -178.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.48 ' CG ' ' O ' ' A' ' 12' ' ' VAL . 1.8 ptm180 -61.59 -23.09 65.77 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 120.895 -0.322 . . . . 70.13 111.622 -178.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.417 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -54.61 178.57 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.739 0.304 . . . . 70.41 110.847 179.773 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -110.27 11.39 23.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.326 -0.397 . . . . 73.44 111.434 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -103.47 -26.18 12.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.765 0.317 . . . . 64.14 111.12 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.63 HD22 HD11 ' A' ' 25' ' ' ILE . 8.5 tt -87.53 130.72 46.24 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.348 -0.387 . . . . 74.11 110.91 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -74.25 127.92 11.65 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.505 2.137 . . . . 54.14 112.369 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -25.06 66.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 74.13 111.193 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.54 ' HA ' HD12 ' A' ' 26' ' ' ILE . 11.8 mmtp -54.08 -39.19 66.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.852 0.358 . . . . 72.34 111.351 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.43 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 0.8 OUTLIER -70.05 -58.35 3.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.198 -0.456 . . . . 74.51 111.093 -179.896 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.63 HD11 HD22 ' A' ' 20' ' ' LEU . 17.9 mt -44.7 -32.62 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.864 -0.607 . . . . 62.53 111.577 -179.566 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.643 HG12 HD21 ' A' ' 59' ' ' LEU . 8.1 mt -75.11 -37.2 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.363 -0.381 . . . . 74.14 111.008 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 mttm -72.43 -23.88 61.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.016 -0.538 . . . . 71.41 111.258 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -73.73 -45.88 49.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.967 0.413 . . . . 73.14 110.917 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.915 HD13 HD13 ' A' ' 43' ' ' LEU . 4.6 mt -67.89 -24.96 65.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.862 -0.608 . . . . 74.1 110.998 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -80.46 -27.86 37.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.35 -0.386 . . . . 74.01 110.98 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.42 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 15.7 pt-20 -94.01 -41.63 9.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.298 -0.41 . . . . 63.04 111.034 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.448 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 21.2 m170 -98.51 16.54 21.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.285 -0.416 . . . . 65.12 111.035 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.26 154.37 23.98 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.81 -0.71 . . . . 64.44 112.525 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.1 p -88.6 148.26 24.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.66 0.267 . . . . 72.45 110.653 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.584 ' HA ' HD12 ' A' ' 38' ' ' LEU . 0.5 OUTLIER -48.8 -57.12 6.87 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.784 0.325 . . . . 61.52 110.988 -179.874 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.5 t -48.03 -51.15 25.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.195 -0.457 . . . . 71.53 110.724 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.498 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 17.1 t80 -55.12 -45.55 75.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.759 -0.655 . . . . 75.24 110.16 179.286 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.656 HD21 ' O ' ' A' ' 29' ' ' LEU . 14.7 mt -63.47 -43.56 96.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.933 -0.576 . . . . 70.43 110.477 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.881 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.5 -34.26 7.29 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.13 -0.487 . . . . 62.12 110.575 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -50.55 -48.36 57.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.65 -0.704 . . . . 51.03 110.76 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -106.36 16.25 25.01 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.947 -0.57 . . . . 74.32 110.883 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.8 mttt 57.27 40.95 27.45 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.833 0.349 . . . . 75.15 110.952 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.915 HD13 HD13 ' A' ' 29' ' ' LEU . 51.0 mt -91.59 -25.38 19.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 34.03 111.597 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.881 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -69.79 158.34 35.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.017 0.437 . . . . 60.4 111.114 -179.761 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.19 -124.77 6.45 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.775 -0.648 . . . . 75.2 112.359 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.834 ' O ' HG23 ' A' ' 50' ' ' VAL . 3.4 m120 -116.39 122.57 45.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.794 0.33 . . . . 61.1 110.88 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.578 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -46.13 -49.4 5.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.219 -0.446 . . . . 73.11 111.29 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.5 mttt -50.75 -39.56 52.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.98 -0.555 . . . . 71.22 110.846 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -85.68 -26.28 26.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.869 -0.605 . . . . 73.3 110.934 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.834 HG23 ' O ' ' A' ' 46' ' ' ASN . 28.5 t -78.8 -25.85 13.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 75.12 111.284 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.56 -19.98 64.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.398 -0.364 . . . . 71.2 111.252 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.1 ptpt -95.06 -33.05 12.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.379 -0.373 . . . . 73.21 110.909 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.83 31.79 2.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 73.52 110.977 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -156.08 125.07 6.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 41.33 111.061 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -84.07 171.7 12.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 65.21 110.722 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.637 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.1 OUTLIER -55.71 -58.08 9.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.917 0.389 . . . . 74.54 110.556 179.915 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.3 -25.71 67.3 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.036 -0.529 . . . . 44.43 110.537 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -46.83 84.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 54.23 110.515 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.643 HD21 HG12 ' A' ' 26' ' ' ILE . 21.9 mt -72.15 -31.18 65.74 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.657 -0.702 . . . . 64.45 111.228 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.795 HG22 ' HB3' ' A' ' 15' ' ' LEU . 15.2 t -79.75 -42.82 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.974 0.416 . . . . 53.31 110.907 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 92.2 m -59.33 -38.02 79.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.941 -0.572 . . . . 73.25 110.774 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.418 ' HA ' ' ND1' ' A' ' 65' ' ' HIS . . . -80.89 -21.81 40.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.314 -0.403 . . . . 65.25 111.108 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.638 ' HA ' HD21 ' A' ' 29' ' ' LEU . 12.9 t80 -82.85 -22.87 33.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 54.43 110.986 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 31.8 m-20 -84.97 -53.62 5.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 45.45 111.583 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.498 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.2 p-80 -61.6 -30.3 70.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.134 -0.485 . . . . 75.23 111.364 -179.423 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.729 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.1 tt -50.21 -39.83 45.43 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.875 0.369 . . . . 72.03 111.101 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -78.8 -36.79 42.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.065 -0.516 . . . . 64.32 110.598 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.12 -38.16 81.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 73.23 110.843 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.8 p -92.73 -6.25 49.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.024 -0.535 . . . . 64.04 111.387 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt 51.55 36.53 17.28 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.768 0.318 . . . . 73.55 111.34 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 41.9 mtt-85 -93.48 44.18 1.13 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.34 -0.391 . . . . 72.21 111.026 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.498 ' HA ' HD21 ' A' ' 66' ' ' LEU . 85.3 m-85 -64.59 173.12 2.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.297 -0.41 . . . . 73.44 110.786 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -62.76 153.03 34.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.273 -0.422 . . . . 72.54 110.9 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.672 ' O ' HG23 ' A' ' 75' ' ' THR . . . -116.32 -111.59 2.71 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.735 -0.745 . . . . 62.11 112.501 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.672 HG23 ' O ' ' A' ' 74' ' ' GLY . 0.7 OUTLIER -170.2 102.19 0.28 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.867 0.365 . . . . 71.4 110.848 179.958 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -111.46 -33.63 6.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.126 -0.488 . . . . 72.5 110.915 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.471 ' O ' HG23 ' A' ' 78' ' ' ILE . 71.0 p -132.97 140.33 47.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.232 -0.44 . . . . 74.44 110.945 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.743 HD12 ' N ' ' A' ' 79' ' ' SER . 2.6 pp -157.47 -44.38 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 73.52 111.212 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.743 ' N ' HD12 ' A' ' 78' ' ' ILE . 22.0 m -92.86 -33.1 14.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.069 -0.514 . . . . 72.13 110.893 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.446 ' O ' HG13 ' A' ' 81' ' ' VAL . 5.0 tttp -92.16 152.22 20.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.452 . . . . 71.15 110.941 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 81' ' ' VAL . 16.8 m -157.08 110.53 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 54.54 111.142 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -177.0 174.87 1.65 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 51.14 110.905 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 63.84 -79.96 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.195 -0.457 . . . . 75.52 111.004 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -90.51 121.54 32.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.152 -0.476 . . . . 72.52 110.912 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.618 HG12 ' H ' ' A' ' 87' ' ' ASN . 19.6 t 64.05 133.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 72.4 111.097 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.1 tttp -97.65 25.58 5.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 73.3 111.125 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.618 ' H ' HG12 ' A' ' 85' ' ' VAL . 2.9 m120 56.74 104.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.339 -0.391 . . . . 73.43 111.086 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.492 HG12 ' H ' ' A' ' 90' ' ' LEU . 20.9 t 63.85 151.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 72.22 111.095 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.62 ' HB3' HD12 ' A' ' 90' ' ' LEU . 4.4 mmmt -86.46 -35.3 19.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 71.21 110.884 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.62 HD12 ' HB3' ' A' ' 89' ' ' LYS . 5.6 mp -147.85 126.59 12.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 70.34 110.903 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -176.88 169.5 2.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.468 . . . . 74.2 110.858 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -81.94 -179.37 7.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 75.44 110.882 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -101.14 120.1 39.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 61.22 110.89 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.94 87.24 40.79 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 51.31 110.886 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.97 168.05 22.96 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.531 2.154 . . . . 74.35 112.281 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? 60.72 104.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 70.22 110.862 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -109.43 -34.1 6.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 73.5 110.914 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.0 t 43.31 68.8 0.46 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.085 -0.507 . . . . 70.54 111.441 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 9.1 tmtt? -60.16 108.21 0.75 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.477 . . . . 74.34 110.863 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.73 -170.16 2.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 73.11 110.898 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -102.42 -31.56 10.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 63.43 110.883 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 60.47 168.95 0.09 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.244 -0.435 . . . . 61.51 110.911 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 37.4 p -111.44 -178.07 3.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 74.22 110.89 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.523 HD23 ' C ' ' A' ' 104' ' ' LEU . 8.5 tt -129.95 117.53 20.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.453 . . . . 73.41 110.861 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -112.06 -34.79 5.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.15 -0.477 . . . . 62.13 110.896 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -96.84 110.77 23.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 74.12 110.889 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 154.7 99.35 0.17 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.65 -0.786 . . . . 70.41 112.476 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.515 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 32.3 Cg_exo -56.4 -46.03 33.23 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.443 2.095 . . . . 71.33 112.839 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' PRO . . . . . 0.515 ' CD ' ' N ' ' A' ' 108' ' ' PRO . 90.9 Cg_endo -82.11 171.23 12.94 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 123.049 2.499 . . . . 64.32 112.263 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.47 ' CG ' ' CD1' ' A' ' 196' ' ' TRP . 8.4 mmtt -110.41 27.36 9.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 55.13 111.043 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -132.62 151.16 52.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.904 0.383 . . . . 71.32 111.022 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 63.8 m -130.94 103.64 6.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.034 -0.53 . . . . 64.11 111.099 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -101.73 142.31 33.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.331 -0.395 . . . . 74.13 110.978 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.593 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.5 m -140.78 118.0 11.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.477 . . . . 45.0 110.76 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.415 HG12 ' N ' ' A' ' 116' ' ' LEU . 39.7 t -57.65 154.75 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 75.22 111.336 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.593 HD12 ' O ' ' A' ' 114' ' ' SER . 4.1 mp -132.8 -46.59 0.87 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.977 -0.556 . . . . 71.3 110.571 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.7 tttm -130.42 108.23 9.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.006 -0.543 . . . . 70.15 110.707 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 20.0 pttt -61.2 131.54 50.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 40.4 110.913 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -100.12 -106.06 2.76 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.713 -0.756 . . . . 74.1 112.345 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.44 -40.21 11.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.916 0.389 . . . . 75.43 110.733 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.9 mtmt 66.75 32.56 6.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.969 -0.56 . . . . 70.12 110.686 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 63.3 m -148.61 -45.14 0.15 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.06 -0.518 . . . . 71.23 110.947 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -91.24 122.24 33.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 54.51 111.0 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -129.07 147.55 65.33 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 75.11 110.88 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.454 ' HA ' HG21 ' A' ' 223' ' ' ILE . 52.6 Cg_exo -52.96 127.4 24.76 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.592 2.195 . . . . 61.41 112.472 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.2 140.66 32.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.182 -0.463 . . . . 74.55 110.777 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -51.88 113.71 1.08 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.242 -0.436 . . . . 72.21 111.172 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.89 -15.14 55.75 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.729 -0.748 . . . . 75.23 112.741 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -88.1 140.95 28.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.826 0.346 . . . . 74.31 111.028 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.588 HG12 ' O ' ' A' ' 224' ' ' ASP . 7.6 p -70.91 163.29 3.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.08 -0.509 . . . . 74.31 110.974 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.933 HG12 HG23 ' A' ' 223' ' ' ILE . 14.0 m -155.21 146.76 13.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 74.2 111.176 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.6 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -127.64 118.0 23.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.711 0.291 . . . . 65.12 110.751 179.705 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.425 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 28.1 p -149.04 166.59 28.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.035 0.445 . . . . 62.24 111.207 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.921 ' HB3' HD11 ' A' ' 149' ' ' ILE . 93.3 m95 -101.8 160.16 14.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.766 -0.652 . . . . 73.15 110.261 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.449 ' CE2' ' ND2' ' A' ' 148' ' ' ASN . 53.1 p90 -163.28 139.48 6.99 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.129 0.49 . . . . 75.21 112.1 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 136' ' ' THR . . . . . 1.13 HG21 HG11 ' A' ' 5' ' ' VAL . 6.9 m -131.22 116.04 17.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.575 -0.739 . . . . 74.42 110.108 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.572 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.65 144.61 17.34 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.661 -0.78 . . . . 43.24 113.443 -179.26 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.633 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -151.75 136.32 16.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.808 0.337 . . . . 74.43 110.411 179.717 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.53 HD21 HD12 ' A' ' 208' ' ' ILE . 31.3 mt -67.81 -178.34 0.94 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 63.24 110.979 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -56.59 -42.1 78.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 75.15 110.89 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.43 -2.48 35.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.976 -0.557 . . . . 74.13 111.504 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' GLY . . . . . 0.442 ' C ' HG22 ' A' ' 138' ' ' THR . . . 88.57 25.78 29.38 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.664 -0.779 . . . . 50.52 112.672 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 31.0 m -90.61 116.37 28.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.8 0.333 . . . . 72.44 110.816 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.438 HG22 HG23 ' A' ' 138' ' ' THR . 24.1 t -63.61 130.24 28.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 73.52 111.064 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.759 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 55.1 p90 -114.68 -31.06 6.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 63.0 111.106 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' ASP . . . . . 0.42 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 2.7 m-20 -168.1 117.5 0.77 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.385 -0.371 . . . . 71.41 111.072 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.552 ' OG1' HG23 ' A' ' 136' ' ' THR . 15.0 t -142.87 129.52 20.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 75.01 110.94 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.449 ' ND2' ' CE2' ' A' ' 135' ' ' TYR . 35.8 p-10 -92.54 50.08 1.56 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.262 -0.426 . . . . 64.35 110.373 179.544 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.921 HD11 ' HB3' ' A' ' 134' ' ' TRP . 19.2 mm -126.95 106.67 15.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.126 -0.488 . . . . 74.3 110.893 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -102.75 -77.31 0.56 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.444 . . . . 61.43 110.975 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 61.8 p -146.53 166.06 27.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 71.33 110.919 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 11.1 m -86.24 159.46 19.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 63.21 110.874 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -66.84 -30.39 70.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 52.32 111.153 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.76 -31.3 69.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 75.43 110.959 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -85.72 -34.38 21.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 75.31 110.907 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -177.3 152.35 0.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 75.43 110.911 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 25.2 mmtt -85.08 76.07 10.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.227 -0.442 . . . . 72.2 110.871 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -154.53 48.35 0.59 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 42.0 110.785 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.2 120.78 4.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 51.13 111.032 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -137.13 133.76 18.61 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 64.11 110.897 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.413 ' HB2' ' HB3' ' A' ' 132' ' ' HIS . 34.5 Cg_exo -56.95 155.94 25.97 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.37 2.047 . . . . 63.25 112.204 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.442 ' O ' HD23 ' A' ' 162' ' ' LEU . 2.6 tt -77.96 119.67 21.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.452 . . . . 73.32 110.382 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.648 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -97.69 121.84 40.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.395 . . . . 75.14 111.384 -179.721 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.881 ' O ' HG22 ' A' ' 131' ' ' VAL . 10.8 p90 -150.36 142.67 24.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.995 -0.548 . . . . 63.45 110.597 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.49 ' HB3' HG21 ' A' ' 168' ' ' VAL . 7.2 mtpt -81.26 141.03 34.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.981 0.42 . . . . 65.04 111.028 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.448 HG11 ' CB ' ' A' ' 125' ' ' PRO . 27.0 m -87.44 149.18 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.837 -0.62 . . . . 52.32 111.138 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 66.91 26.28 73.2 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.792 -0.718 . . . . 34.3 112.269 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.49 HG21 ' HB3' ' A' ' 165' ' ' LYS . 2.0 t -131.18 41.19 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.831 0.348 . . . . 75.43 110.984 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.02 34.84 3.23 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 121.105 -0.569 . . . . 73.3 112.966 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.62 -45.8 13.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.885 0.374 . . . . 73.04 111.016 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.1 m -118.41 179.55 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.042 -0.526 . . . . 64.12 111.066 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.537 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -61.82 159.07 2.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.262 -0.426 . . . . 74.43 111.246 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -65.08 -30.16 71.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.158 -0.474 . . . . 72.51 111.292 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.8 -36.21 43.04 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.529 -0.843 . . . . 45.44 112.197 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.723 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.5 t90 -80.22 -36.06 35.3 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.914 0.388 . . . . 63.42 110.91 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -60.89 -36.4 79.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.993 -0.549 . . . . 75.4 110.37 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 177' ' ' GLU . . . . . 0.763 ' O ' HG23 ' A' ' 181' ' ' THR . 3.9 mm-40 -78.04 -29.04 49.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.957 -0.565 . . . . 71.02 110.627 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.654 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -77.71 -60.44 2.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.202 -0.453 . . . . 75.04 111.144 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.669 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 7.1 mt -55.54 -35.98 66.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.984 -0.553 . . . . 50.32 110.897 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.7 tp -62.11 -28.77 69.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.224 -0.444 . . . . 70.12 110.835 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 181' ' ' THR . . . . . 0.763 HG23 ' O ' ' A' ' 177' ' ' GLU . 37.0 p -89.32 -8.54 53.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 75.14 111.369 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 9.4 mmm -75.47 159.4 31.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.762 0.315 . . . . 75.24 110.829 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.91 166.78 10.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 73.23 111.079 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 184' ' ' LYS . . . . . 0.716 ' HA ' HD22 ' A' ' 220' ' ' LEU . 5.5 tttm -65.56 123.35 19.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 53.44 111.095 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 70.24 39.27 71.79 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.737 -0.744 . . . . 55.25 112.702 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -121.16 149.78 42.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.834 0.35 . . . . 71.41 110.999 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -116.53 139.29 50.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 63.33 110.226 179.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -147.79 175.84 10.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.058 0.456 . . . . 71.12 111.642 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.7 124.49 21.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.722 -0.672 . . . . 73.23 109.838 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.702 HD11 ' CD1' ' A' ' 175' ' ' TRP . 1.3 pt? -135.91 142.14 44.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.187 0.518 . . . . 74.33 112.152 -179.213 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.687 ' HG3' HG23 ' A' ' 215' ' ' THR . 0.6 OUTLIER -117.35 113.42 22.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.416 -0.811 . . . . 62.52 110.15 179.302 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.574 HG21 ' O ' ' A' ' 196' ' ' TRP . 4.6 mp -96.57 142.77 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.975 0.417 . . . . 55.42 111.458 -179.556 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -78.77 164.43 55.51 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 115.88 -0.6 . . . . 73.12 110.834 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.83 -41.43 75.53 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.661 2.241 . . . . 42.04 112.409 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -63.28 -39.0 93.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 71.03 111.162 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.574 ' O ' HG21 ' A' ' 192' ' ' ILE . 9.0 m0 -96.3 27.1 3.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.359 -0.382 . . . . 74.33 111.103 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -150.04 -81.84 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 34.3 110.792 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -104.25 -71.27 0.74 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.039 0.447 . . . . 74.21 110.444 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 145.83 -174.36 25.82 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.823 -0.703 . . . . 72.02 112.808 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -56.9 -40.96 77.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.826 0.346 . . . . 71.23 110.895 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.46 -52.01 65.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.126 -0.488 . . . . 73.52 110.592 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.1 -139.46 14.56 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.84 -0.695 . . . . 63.13 112.519 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.406 ' HA ' ' HD2' ' A' ' 204' ' ' PRO . 2.1 mm-40 -150.89 90.35 4.19 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 120.656 0.265 . . . . 64.42 110.621 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 204' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 203' ' ' GLN . 23.8 Cg_endo -61.86 -22.57 74.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.523 2.149 . . . . 72.11 112.668 -179.627 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.65 -42.18 64.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.86 0.362 . . . . 72.14 110.889 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.759 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -97.59 25.76 5.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.064 -0.516 . . . . 74.22 111.358 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 54.71 32.45 17.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.344 -0.389 . . . . 63.34 111.16 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.53 HD12 HD21 ' A' ' 139' ' ' LEU . 20.2 mm -95.72 111.79 56.96 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 73.44 111.118 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 209' ' ' PRO . . . . . 0.788 ' HG2' ' HB2' ' A' ' 212' ' ' ALA . 39.9 Cg_endo -67.23 171.46 11.48 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.34 2.027 . . . . 75.1 112.171 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -68.72 122.17 9.1 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.535 2.157 . . . . 53.44 112.314 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 71.42 34.47 1.7 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.214 -0.448 . . . . 75.04 110.988 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 212' ' ' ALA . . . . . 0.788 ' HB2' ' HG2' ' A' ' 209' ' ' PRO . . . -83.86 147.38 27.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.046 0.45 . . . . 65.31 111.768 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 213' ' ' LYS . . . . . 0.453 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.1 OUTLIER -88.62 148.05 24.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.776 -0.647 . . . . 53.02 110.367 179.473 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.453 HD23 ' O ' ' A' ' 213' ' ' LYS . 5.5 mt -130.03 109.11 10.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.883 0.373 . . . . 63.54 111.767 -179.592 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.687 HG23 ' HG3' ' A' ' 191' ' ' GLU . 50.3 m -111.3 141.45 44.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.109 -0.496 . . . . 70.13 110.612 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.572 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 11.6 p90 -153.96 178.17 10.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.107 0.48 . . . . 70.23 111.717 -179.74 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 217' ' ' GLU . . . . . 0.462 ' OE2' HD22 ' A' ' 116' ' ' LEU . 1.4 mt-10 -127.9 132.13 49.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.604 -0.725 . . . . 63.3 110.123 179.409 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.723 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.4 t -120.8 149.04 23.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.121 0.486 . . . . 64.45 112.034 -178.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -136.73 109.85 7.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.584 -0.734 . . . . 75.14 110.253 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.778 HD21 HG13 ' A' ' 223' ' ' ILE . 3.2 tt -69.92 134.33 48.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.342 -0.39 . . . . 71.14 110.89 -179.646 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.441 ' N ' HD23 ' A' ' 220' ' ' LEU . 40.4 t -112.08 -29.96 2.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.252 -0.431 . . . . 50.14 111.392 -179.745 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 222' ' ' ASP . . . . . 0.455 ' N ' HD23 ' A' ' 220' ' ' LEU . 13.4 t70 -168.82 158.71 9.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.821 0.343 . . . . 62.31 111.176 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.933 HG23 HG12 ' A' ' 131' ' ' VAL . 35.1 mt -141.62 111.53 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 72.53 111.168 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 224' ' ' ASP . . . . . 0.588 ' O ' HG12 ' A' ' 130' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 75.31 110.841 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.823 0.344 . . . . 74.14 111.157 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -175.23 124.53 0.24 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.179 -0.464 . . . . 52.21 111.06 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.36 30.4 2.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.476 . . . . 75.01 111.155 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.75 154.65 41.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 54.55 111.078 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.511 HG23 ' OG1' ' A' ' 138' ' ' THR . 60.5 t -60.05 110.5 2.88 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.183 -0.462 . . . . 71.21 111.086 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.414 ' HD2' ' CE1' ' A' ' 72' ' ' PHE . 90.2 Cg_endo -80.7 146.15 16.59 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.813 2.342 . . . . 62.31 112.469 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.458 ' OE1' HD11 ' A' ' 149' ' ' ILE . 3.2 tp-100 -84.34 152.21 24.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 75.22 110.743 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 mpp_? -52.4 121.31 6.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 65.03 111.116 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -93.78 -13.05 27.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 72.22 111.376 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.631 ' NE1' HD11 ' A' ' 20' ' ' LEU . 1.2 m-90 -137.12 173.73 11.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.877 0.37 . . . . 74.24 110.681 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 m -117.11 151.36 36.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.06 -0.518 . . . . 70.33 110.58 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.522 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.4 t -57.18 -33.17 42.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.065 0.46 . . . . 65.03 110.364 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.53 -28.25 61.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.696 -0.684 . . . . 74.44 111.058 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -82.06 -57.75 3.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.323 -0.399 . . . . 74.41 110.994 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.756 ' HB3' HG22 ' A' ' 60' ' ' VAL . 2.5 mt -50.32 -62.24 1.7 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.198 -0.456 . . . . 64.43 111.092 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.531 ' HG3' HG11 ' A' ' 60' ' ' VAL . 26.0 mtt180 -54.37 -24.35 19.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 65.3 111.268 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.98 173.69 0.31 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.334 -0.394 . . . . 45.51 111.082 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.32 16.35 21.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 64.43 111.237 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -107.73 -25.32 11.33 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.547 -0.297 . . . . 74.42 111.011 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.941 HD22 HD11 ' A' ' 25' ' ' ILE . 10.3 tt -86.13 129.48 53.69 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.293 -0.412 . . . . 73.21 110.874 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.29 123.14 9.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.332 2.021 . . . . 43.34 112.32 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -24.06 66.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 74.24 111.211 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.9 mmtp -53.38 -39.31 64.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.396 -0.365 . . . . 61.44 111.396 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -79.02 -29.04 43.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.324 -0.398 . . . . 73.4 111.209 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.941 HD11 HD22 ' A' ' 20' ' ' LEU . 49.0 mt -66.18 -37.12 79.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.32 -0.4 . . . . 55.1 111.096 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.702 HG12 HD21 ' A' ' 59' ' ' LEU . 10.3 mt -72.53 -44.47 61.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 73.11 110.938 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.417 ' HG3' HD11 ' A' ' 47' ' ' ILE . 1.2 mtpt -59.53 -24.17 63.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.847 -0.615 . . . . 71.32 111.026 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -74.87 -50.08 18.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 73.21 110.894 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.898 HD23 HD12 ' A' ' 66' ' ' LEU . 5.1 mt -65.13 -40.69 94.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.963 -0.562 . . . . 70.53 110.919 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -67.89 -23.73 65.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.219 -0.446 . . . . 41.04 110.492 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -88.03 -48.21 7.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.086 -0.506 . . . . 75.55 110.885 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -97.23 16.44 19.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 63.05 111.307 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -131.34 151.93 19.86 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.661 -0.781 . . . . 62.1 112.408 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.83 154.05 19.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.685 0.279 . . . . 73.04 110.618 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.541 ' O ' HD21 ' A' ' 44' ' ' LEU . 0.7 OUTLIER -46.98 -52.67 14.14 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.527 -0.306 . . . . 55.14 111.337 -179.806 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 57.8 m -53.01 -46.54 68.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.012 0.434 . . . . 42.01 110.68 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.455 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 11.2 t80 -56.6 -48.25 77.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.785 -0.643 . . . . 54.31 110.726 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.718 HD22 ' HB3' ' A' ' 43' ' ' LEU . 13.4 mt -63.46 -45.2 91.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 74.3 110.889 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.929 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -48.07 -34.01 8.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 71.2 111.155 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -59.22 -55.39 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.996 -0.547 . . . . 55.11 111.025 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 -95.59 15.29 20.25 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.175 -0.466 . . . . 75.11 111.411 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 mttp 60.08 38.24 20.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.736 0.303 . . . . 71.22 111.182 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.718 ' HB3' HD22 ' A' ' 38' ' ' LEU . 14.3 mt -85.12 -21.76 29.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.373 -0.376 . . . . 62.3 110.796 179.637 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.929 HD11 ' HB2' ' A' ' 39' ' ' ALA . 81.2 mt -47.08 170.82 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.175 -0.466 . . . . 63.31 111.344 179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.71 -148.95 20.2 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.913 -0.661 . . . . 52.32 112.869 179.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.824 ' O ' HG23 ' A' ' 50' ' ' VAL . 4.6 m-20 -114.85 149.16 37.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.005 0.431 . . . . 73.52 111.16 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.699 HG23 HD12 ' A' ' 26' ' ' ILE . 3.4 mp -45.62 -42.03 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.847 -0.615 . . . . 55.31 111.599 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.21 -43.45 82.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.961 -0.563 . . . . 75.13 111.198 -179.838 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -85.71 -27.1 25.51 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.076 -0.511 . . . . 74.45 111.292 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 46' ' ' ASN . 35.3 t -76.74 -26.2 16.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.386 -0.37 . . . . 73.13 111.441 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.78 -25.39 65.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.442 -0.344 . . . . 33.2 111.366 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.29 -30.54 13.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 73.44 111.103 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -84.05 -19.76 33.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.264 -0.426 . . . . 42.52 111.471 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -117.74 130.13 56.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.865 0.364 . . . . 74.51 111.32 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -78.65 -179.09 6.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 73.01 110.48 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.571 ' O ' HG23 ' A' ' 60' ' ' VAL . 2.5 tpmp? -61.4 -58.45 8.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.796 0.332 . . . . 73.13 110.524 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -25.51 67.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.196 -0.456 . . . . 75.44 110.646 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.04 -40.06 94.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.11 0.481 . . . . 73.25 110.214 179.693 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.702 HD21 HG12 ' A' ' 26' ' ' ILE . 15.3 mt -77.07 -30.14 55.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.619 -0.719 . . . . 73.22 111.013 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.756 HG22 ' HB3' ' A' ' 15' ' ' LEU . 17.3 t -79.66 -43.48 23.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.991 0.424 . . . . 75.32 110.737 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 63.7 m -59.32 -34.8 72.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.945 -0.571 . . . . 61.5 110.448 179.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.446 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -82.64 -21.19 35.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.544 . . . . 72.01 110.997 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.78 ' HA ' HD21 ' A' ' 29' ' ' LEU . 14.2 t80 -83.63 -22.64 32.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.094 -0.503 . . . . 74.43 110.918 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 30.2 m-20 -85.06 -53.88 4.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 73.44 111.401 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.428 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.8 p-80 -62.33 -27.27 68.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.097 -0.501 . . . . 73.44 111.323 -179.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.898 HD12 HD23 ' A' ' 29' ' ' LEU . 3.8 tt -50.82 -40.79 56.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.899 0.38 . . . . 63.3 111.065 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.405 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.6 m-85 -79.05 -40.06 32.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.035 -0.53 . . . . 74.02 110.679 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -64.88 -39.75 94.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.961 -0.563 . . . . 74.32 110.972 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.2 p -88.98 -10.38 47.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.001 -0.545 . . . . 61.23 111.399 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt 53.55 33.21 15.77 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.683 0.277 . . . . 60.32 111.21 179.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -92.42 45.84 1.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 75.32 111.026 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.476 ' CE1' HD22 ' A' ' 66' ' ' LEU . 94.5 m-85 -64.86 171.87 3.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 62.4 110.801 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 33.9 tttt -62.87 150.91 40.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.325 -0.398 . . . . 73.31 110.914 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -91.09 -137.28 7.21 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.696 -0.764 . . . . 43.22 112.455 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -115.04 -38.47 3.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.906 0.384 . . . . 73.13 110.93 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 58.57 75.46 0.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.102 -0.499 . . . . 74.34 110.916 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.531 ' O ' HG23 ' A' ' 78' ' ' ILE . 1.4 t 60.42 158.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 62.33 110.926 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.531 HG23 ' O ' ' A' ' 77' ' ' SER . 4.1 pt -158.73 145.15 7.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 75.01 111.11 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 34.3 p -67.01 135.62 54.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 64.41 110.896 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.15 30.96 3.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 72.53 110.91 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.4 t 62.1 116.58 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 74.45 111.149 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -129.97 149.35 51.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 71.21 110.875 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -128.79 -49.71 1.24 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 65.2 110.89 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -141.76 125.65 17.12 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.923 -0.58 . . . . 74.41 110.892 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -110.13 -32.35 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.443 . . . . 54.51 111.123 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.41 179.43 4.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 72.12 110.91 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.462 ' O ' HG12 ' A' ' 88' ' ' VAL . 1.9 t-20 -135.44 169.15 17.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 72.01 110.857 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.604 HG22 ' O ' ' A' ' 88' ' ' VAL . 12.7 p 43.82 35.26 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-N 116.073 -0.512 . . . . 61.23 111.595 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.692 ' O ' HD22 ' A' ' 90' ' ' LEU . 3.0 tttm -132.63 -45.49 0.89 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.126 -0.488 . . . . 35.52 110.969 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.692 HD22 ' O ' ' A' ' 89' ' ' LYS . 4.6 mm? -129.76 134.66 47.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.089 -0.505 . . . . 70.4 110.894 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -107.47 -33.12 7.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.255 -0.43 . . . . 65.0 110.947 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 60.64 157.71 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.187 -0.46 . . . . 74.34 110.911 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -110.9 -33.57 6.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.223 -0.444 . . . . 55.43 110.919 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -173.84 86.97 0.36 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 73.02 110.892 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.95 139.06 38.66 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.616 2.21 . . . . 65.55 112.306 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -142.85 123.64 14.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.262 -0.426 . . . . 72.15 110.894 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -143.49 142.87 31.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 74.1 110.875 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 20.7 p -138.04 130.31 29.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 74.43 110.969 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.99 139.93 36.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 72.0 110.892 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.3 m -126.84 159.4 34.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 73.04 110.9 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -104.62 -32.97 8.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 73.45 110.899 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -95.23 152.51 18.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.187 -0.461 . . . . 42.22 110.941 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 58.5 p -94.16 -33.56 13.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 74.41 110.922 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 59.89 96.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 73.11 110.916 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -107.57 -36.81 6.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 73.44 110.907 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -165.12 -43.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.094 -0.503 . . . . 61.35 111.02 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 133.58 69.49 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.792 -0.718 . . . . 40.21 112.512 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.82 176.47 6.77 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.584 2.19 . . . . 50.34 112.313 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -57.41 -159.49 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.671 2.247 . . . . 75.24 112.289 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.442 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -97.24 28.03 3.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 73.41 111.048 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.476 ' CE1' ' HB2' ' A' ' 178' ' ' ALA . 29.5 p90 -152.64 151.61 30.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.295 -0.412 . . . . 73.33 110.848 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 74.1 m -122.14 103.54 8.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 72.04 110.857 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.9 ttpt -95.92 145.52 25.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.328 -0.397 . . . . 73.1 111.11 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.428 ' O ' HD22 ' A' ' 116' ' ' LEU . 1.7 m -138.35 117.78 12.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 34.45 110.727 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 22.8 t -81.07 106.36 12.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.294 -0.412 . . . . 44.34 111.267 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.533 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -82.23 -42.0 19.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 74.32 110.67 179.761 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -125.05 107.72 11.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 53.4 110.927 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.1 mtmp? -63.64 139.29 58.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 62.35 110.953 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -112.67 -155.02 12.09 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.779 -0.724 . . . . 64.22 112.279 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -33.59 -50.46 0.34 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.917 0.389 . . . . 62.35 111.705 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.1 tttt 71.65 35.64 1.39 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.028 -0.533 . . . . 63.32 110.177 -179.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 75.0 m -163.62 -43.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.664 -0.698 . . . . 71.34 110.525 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -85.3 88.63 7.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.048 -0.524 . . . . 65.02 110.713 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -104.6 155.14 37.85 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 72.41 110.763 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.643 ' HB2' HG21 ' A' ' 166' ' ' VAL . 51.6 Cg_endo -69.49 125.55 12.41 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.433 2.089 . . . . 54.22 112.436 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -95.46 152.29 18.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.007 -0.542 . . . . 63.52 110.9 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.99 116.95 3.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.278 -0.419 . . . . 51.23 110.981 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 100.59 -26.99 22.52 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.73 -0.748 . . . . 75.33 112.519 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -73.13 137.62 45.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.835 0.35 . . . . 53.12 110.905 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.679 HG23 ' HG3' ' A' ' 165' ' ' LYS . 1.2 t -71.16 163.65 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 74.14 110.944 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.728 HG22 ' O ' ' A' ' 164' ' ' PHE . 2.8 m -153.77 145.27 14.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.038 -0.528 . . . . 73.13 110.884 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.449 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.3 OUTLIER -127.18 117.72 22.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.708 0.289 . . . . 75.13 110.658 179.591 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.738 ' HB3' HD22 ' A' ' 220' ' ' LEU . 28.4 p -153.23 167.64 28.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.965 0.412 . . . . 52.23 111.15 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.629 ' O ' HG13 ' A' ' 218' ' ' VAL . 8.4 m95 -102.64 162.98 12.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.928 -0.578 . . . . 73.22 110.067 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.673 ' CE1' HD13 ' A' ' 162' ' ' LEU . 46.3 p90 -162.3 138.4 7.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.078 0.466 . . . . 74.34 111.667 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.85 HG23 ' OG1' ' A' ' 147' ' ' THR . 0.2 OUTLIER -127.49 112.64 15.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.674 -0.694 . . . . 63.4 110.477 179.674 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.608 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.5 143.7 16.87 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.619 -0.801 . . . . 60.02 113.001 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.621 HG23 ' CG1' ' A' ' 144' ' ' VAL . 0.1 OUTLIER -151.47 139.01 19.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.758 0.313 . . . . 73.54 110.539 179.653 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.744 HD21 HG23 ' A' ' 208' ' ' ILE . 70.8 mt -72.0 -178.58 2.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.288 -0.415 . . . . 63.33 111.031 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -58.3 -42.32 86.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 71.24 110.752 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.87 -4.41 40.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.927 -0.579 . . . . 73.04 111.418 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' GLY . . . . . 0.583 ' C ' HG22 ' A' ' 138' ' ' THR . . . 90.68 21.73 36.04 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.674 -0.774 . . . . 72.14 112.726 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -90.66 109.12 20.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.8 0.333 . . . . 51.02 110.686 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.621 ' CG1' HG23 ' A' ' 138' ' ' THR . 3.1 m -63.58 139.93 20.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 44.32 111.165 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 33.7 p90 -118.85 -40.53 2.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.055 -0.52 . . . . 64.04 111.071 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -155.17 119.98 4.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.074 -0.512 . . . . 61.54 110.727 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.85 ' OG1' HG23 ' A' ' 136' ' ' THR . 3.5 t -142.82 129.39 20.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.279 -0.419 . . . . 73.44 111.327 -179.831 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.483 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 26.5 t-20 -93.62 46.65 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 72.41 110.435 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.551 HD13 ' HB3' ' A' ' 134' ' ' TRP . 17.6 mm -113.29 89.36 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.923 -0.581 . . . . 62.21 110.905 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -81.4 -173.49 4.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 62.32 110.877 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' THR . . . . . 0.56 ' O ' ' HB2' ' A' ' 159' ' ' ALA . 41.8 p -64.82 165.95 9.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.126 -0.488 . . . . 55.15 110.927 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 11.3 p -69.73 158.04 36.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 52.32 110.943 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -78.54 -28.37 46.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 73.34 111.165 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.1 tptm -57.62 -28.94 64.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.212 -0.449 . . . . 73.23 111.032 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 9.7 mmtm -58.86 -63.14 1.4 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.955 0.407 . . . . 72.41 110.918 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -166.92 32.03 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.912 -0.585 . . . . 73.24 110.935 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 22.6 mttt 56.22 75.62 0.33 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 64.33 110.981 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -140.64 50.4 1.67 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 73.32 110.89 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.616 ' HB1' ' HH2' ' A' ' 134' ' ' TRP . . . -149.08 125.19 10.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 50.41 111.129 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 5.7 tttm -138.69 120.36 10.26 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 74.21 110.863 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.418 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 43.7 Cg_exo -56.33 150.96 47.11 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.378 2.052 . . . . 64.03 112.28 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.673 HD13 ' CE1' ' A' ' 135' ' ' TYR . 5.5 tt -74.17 121.73 21.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 63.03 110.563 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.563 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.1 OUTLIER -99.29 120.36 39.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.94 0.4 . . . . 72.23 111.11 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.728 ' O ' HG22 ' A' ' 131' ' ' VAL . 6.4 p90 -148.47 140.66 24.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.045 -0.525 . . . . 65.53 110.455 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.679 ' HG3' HG23 ' A' ' 130' ' ' VAL . 82.3 mttt -80.19 139.1 36.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.066 0.46 . . . . 74.22 111.192 -179.681 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.643 HG21 ' HB2' ' A' ' 125' ' ' PRO . 34.8 m -87.77 149.17 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.738 -0.664 . . . . 73.13 111.16 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.53 21.92 78.68 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.831 -0.7 . . . . 65.0 112.822 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.751 HG23 ' HG3' ' A' ' 170' ' ' LYS . 16.0 m -128.0 41.68 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.881 0.372 . . . . 74.21 111.18 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 41.21 38.19 1.8 Allowed Glycine 0 C--N 1.332 0.356 0 CA-C-N 115.975 -0.557 . . . . 71.15 113.403 179.517 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 170' ' ' LYS . . . . . 0.751 ' HG3' HG23 ' A' ' 168' ' ' VAL . 6.8 mtpp -87.38 -39.95 14.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.807 0.337 . . . . 44.42 111.077 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.5 m -119.03 177.13 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.205 -0.452 . . . . 75.12 110.925 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.531 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.42 158.6 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.339 -0.391 . . . . 73.13 111.331 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -67.34 -26.75 66.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.096 -0.502 . . . . 65.12 111.072 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.46 -37.07 36.77 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.615 -0.802 . . . . 73.12 112.087 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.668 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.5 t90 -78.2 -33.72 49.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.965 0.412 . . . . 75.32 111.044 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 176' ' ' ASP . . . . . 0.484 ' O ' HD13 ' A' ' 180' ' ' LEU . 4.3 t70 -64.65 -36.56 84.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.99 -0.55 . . . . 74.11 110.525 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -75.5 -29.58 59.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.025 -0.534 . . . . 73.4 110.648 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.672 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -81.46 -46.5 14.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 63.13 111.125 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.577 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 10.6 mt -70.67 -18.97 62.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.977 -0.556 . . . . 73.24 111.117 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.484 HD13 ' O ' ' A' ' 176' ' ' ASP . 2.2 tp -55.31 -23.06 21.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.453 -0.34 . . . . 72.13 111.453 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 27.0 p -115.95 19.92 14.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.588 -0.278 . . . . 71.03 111.565 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 2.2 mmt -66.17 108.15 2.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.843 0.354 . . . . 71.43 110.89 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.78 145.23 43.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 73.53 110.853 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.67 115.53 2.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 73.3 111.191 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 76.61 21.88 73.8 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.967 -0.635 . . . . 73.33 113.002 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -98.38 144.56 27.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.875 0.369 . . . . 71.33 111.201 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 10.6 ttpt -117.1 139.09 51.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.04 -0.527 . . . . 73.22 110.077 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.64 174.34 11.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.177 0.513 . . . . 62.11 112.0 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.54 107.35 6.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.478 -0.783 . . . . 74.31 109.701 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.672 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.0 OUTLIER -120.16 142.06 49.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.184 0.516 . . . . 63.03 112.105 -178.855 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.629 ' HG3' HG23 ' A' ' 215' ' ' THR . 0.3 OUTLIER -114.32 119.72 37.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.54 -0.755 . . . . 73.11 110.112 179.272 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.521 ' N ' HD13 ' A' ' 192' ' ' ILE . 0.9 OUTLIER -98.26 151.29 4.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.911 0.386 . . . . 74.31 111.173 -179.593 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -86.76 165.14 34.0 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.518 . . . . 63.31 110.715 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -62.12 -42.19 31.0 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.492 2.128 . . . . 73.12 112.246 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -59.0 -39.0 80.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.265 -0.425 . . . . 63.14 111.066 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.442 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 8.9 m0 -97.6 36.94 1.43 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.324 -0.398 . . . . 65.21 110.985 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -162.75 -77.55 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.444 . . . . 44.1 110.749 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 198' ' ' TYR . . . . . 0.746 ' CE2' HD13 ' A' ' 208' ' ' ILE . 23.0 m-85 -105.12 -71.22 0.75 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 72.0 110.516 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.21 175.46 14.1 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.873 -0.68 . . . . 62.4 112.845 179.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -26.38 63.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.782 0.325 . . . . 74.44 110.983 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -67.43 -52.61 37.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.976 0.417 . . . . 71.22 110.776 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 102.33 168.33 26.79 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.87 -0.681 . . . . 73.51 112.515 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.509 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.5 OUTLIER -107.43 91.63 7.26 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.657 0.265 . . . . 73.11 110.791 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -66.95 -21.03 50.51 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.462 2.108 . . . . 61.35 112.477 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.05 -42.05 98.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.873 0.368 . . . . 72.21 110.949 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -105.92 31.18 5.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.102 -0.499 . . . . 72.32 111.15 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 30.9 mttt 54.33 28.28 9.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 74.02 111.039 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.746 HD13 ' CE2' ' A' ' 198' ' ' TYR . 60.1 mt -89.07 113.55 56.64 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 73.41 110.966 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.26 171.5 11.45 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.447 2.098 . . . . 52.44 112.458 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.44 152.62 70.99 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.606 2.204 . . . . 74.51 112.378 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 46.4 32.14 1.48 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.19 -0.459 . . . . 74.41 111.228 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -79.9 144.29 33.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 63.51 111.483 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 213' ' ' LYS . . . . . 0.619 ' O ' HD23 ' A' ' 214' ' ' LEU . 18.5 tttt -89.55 144.72 25.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.938 -0.574 . . . . 74.31 110.258 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.631 HD11 ' CE2' ' A' ' 198' ' ' TYR . 8.0 mt -127.0 108.88 11.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.876 0.369 . . . . 62.41 111.7 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.629 HG23 ' HG3' ' A' ' 191' ' ' GLU . 56.2 m -109.67 143.18 39.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 52.43 110.501 179.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.608 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 15.0 p90 -156.05 178.38 10.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.108 0.48 . . . . 65.22 111.336 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -134.3 137.71 44.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.667 -0.697 . . . . 71.32 110.314 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.668 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.1 t -123.71 151.95 28.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.018 0.437 . . . . 73.04 111.876 -178.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -136.74 110.42 8.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.793 -0.639 . . . . 74.45 110.27 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.738 HD22 ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.47 132.81 46.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.426 -0.352 . . . . 74.44 110.758 -179.584 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.499 HG21 ' HE1' ' A' ' 134' ' ' TRP . 20.6 t -111.11 -31.45 2.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.279 -0.419 . . . . 64.42 111.469 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -170.66 161.97 7.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.904 0.383 . . . . 63.13 110.983 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.546 HG23 HG12 ' A' ' 131' ' ' VAL . 4.2 mp -139.48 109.61 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 72.55 111.058 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 75.0 110.906 179.977 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 ttt . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.816 0.341 . . . . 71.14 111.195 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -140.29 82.1 1.84 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 64.14 111.098 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -161.31 78.54 0.57 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.467 . . . . 54.31 111.092 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.31 152.38 43.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 72.21 111.086 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.849 HG11 HG21 ' A' ' 136' ' ' THR . 57.3 t -60.02 109.83 2.32 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.487 . . . . 65.11 111.062 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.457 ' HA ' ' HG2' ' A' ' 217' ' ' GLU . 98.3 Cg_endo -85.92 149.78 9.65 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 123.007 2.471 . . . . 71.13 112.552 -179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.443 ' NE2' HD11 ' A' ' 149' ' ' ILE . 0.8 OUTLIER -84.43 147.2 27.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 43.21 110.972 -179.953 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.28 99.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 73.31 111.234 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.42 -18.35 61.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 51.34 111.268 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.431 ' CH2' ' HB3' ' A' ' 24' ' ' ASP . 2.2 m-90 -131.81 173.35 11.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.865 0.364 . . . . 71.04 110.737 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.74 153.64 27.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.108 -0.496 . . . . 74.44 110.452 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.681 HG21 ' CB ' ' A' ' 152' ' ' SER . 33.6 t -54.75 -35.01 31.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.983 0.42 . . . . 75.45 110.817 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.44 -34.32 78.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.985 -0.552 . . . . 64.12 111.069 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.457 ' HG2' HD12 ' A' ' 20' ' ' LEU . 0.8 OUTLIER -78.5 -55.43 5.22 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.798 0.332 . . . . 73.24 111.044 -179.902 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.709 ' HB3' HG22 ' A' ' 60' ' ' VAL . 8.2 mt -50.7 -30.76 14.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.993 0.425 . . . . 74.04 110.855 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.613 ' HD2' HG12 ' A' ' 12' ' ' VAL . 47.7 mtt180 -90.95 -28.77 17.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.829 -0.623 . . . . 75.31 110.397 179.421 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 31.0 t -49.37 176.0 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.901 -0.591 . . . . 74.24 111.484 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -110.37 17.41 20.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.746 -0.661 . . . . 74.41 111.234 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -117.67 -16.45 10.06 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.63 -0.259 . . . . 75.51 111.495 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.457 HD12 ' HG2' ' A' ' 14' ' ' GLN . 2.1 tt -87.72 112.49 49.07 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-O 120.55 0.214 . . . . 74.43 111.028 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.09 125.35 17.87 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.478 2.119 . . . . 61.13 112.182 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -24.23 62.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.444 . . . . 63.52 111.161 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -55.07 -43.64 74.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.366 -0.379 . . . . 73.53 111.474 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.431 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 1.5 m-20 -69.32 -54.8 12.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.27 -0.423 . . . . 74.51 111.202 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 41.1 mt -46.36 -33.25 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.929 -0.578 . . . . 62.25 111.422 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.549 HG12 HD22 ' A' ' 59' ' ' LEU . 8.2 mt -77.78 -38.03 24.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.315 -0.402 . . . . 70.33 111.033 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -67.11 -23.15 65.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.11 -0.495 . . . . 74.34 111.102 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -77.37 -49.8 14.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.036 0.446 . . . . 74.45 110.92 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 1.054 HD23 HD12 ' A' ' 66' ' ' LEU . 6.5 mt -61.77 -21.42 64.54 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.747 -0.661 . . . . 73.41 111.185 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.503 ' HA ' HD11 ' A' ' 38' ' ' LEU . 72.2 mt-30 -81.5 -58.72 2.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.99 0.424 . . . . 72.3 110.945 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -63.72 -37.45 87.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.844 -0.616 . . . . 75.34 111.746 -179.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.425 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 14.4 m170 -94.57 -7.9 39.75 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.764 0.283 . . . . 72.3 111.764 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.46 162.28 12.97 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.581 -0.819 . . . . 53.31 112.419 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.6 p -91.79 148.46 22.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.532 0.206 . . . . 53.3 110.524 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.732 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.7 OUTLIER -48.98 -57.08 7.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.803 0.335 . . . . 74.05 111.136 -179.729 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.8 t -48.1 -50.33 28.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.018 0.437 . . . . 61.31 110.772 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.537 ' CD1' ' HB2' ' A' ' 71' ' ' ARG . 15.9 t80 -54.09 -47.66 71.51 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.804 -0.635 . . . . 72.04 110.468 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.7 HD21 ' O ' ' A' ' 29' ' ' LEU . 13.5 mt -64.88 -41.7 95.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.944 -0.571 . . . . 71.43 110.754 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.811 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.85 -42.18 25.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.09 0.471 . . . . 73.05 110.889 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -60.53 -28.09 68.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.686 -0.688 . . . . 64.14 110.883 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 -112.56 10.02 19.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.221 -0.445 . . . . 73.13 111.131 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.91 36.2 17.72 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.801 0.334 . . . . 61.41 110.987 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.793 HD13 HD13 ' A' ' 29' ' ' LEU . 15.6 mt -95.86 -19.79 19.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 74.44 111.756 -179.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.811 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -77.13 159.66 29.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.077 0.465 . . . . 65.41 111.071 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.05 -122.22 5.56 Favored Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 115.706 -0.679 . . . . 74.0 112.367 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.782 ' O ' HG23 ' A' ' 50' ' ' VAL . 14.5 m120 -116.39 119.19 34.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.784 0.326 . . . . 73.43 110.925 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.535 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -46.07 -52.84 2.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.205 -0.452 . . . . 60.22 111.33 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -48.06 -36.96 13.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.914 -0.585 . . . . 70.11 110.742 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -85.61 -26.1 26.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.874 -0.603 . . . . 74.04 110.884 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.782 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.6 t -79.99 -25.97 11.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.289 -0.414 . . . . 72.41 111.331 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.33 -23.75 67.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.386 -0.37 . . . . 73.34 111.102 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -95.28 -28.62 14.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.246 -0.434 . . . . 71.43 110.883 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.5 m -101.99 33.7 2.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 61.42 110.92 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -162.45 126.45 3.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 64.24 110.944 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.72 168.12 14.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.474 . . . . 72.02 110.704 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.543 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -52.77 -58.11 7.93 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.896 0.379 . . . . 74.31 110.505 179.866 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.66 -28.56 65.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.144 -0.48 . . . . 74.15 110.187 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.48 96.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.897 -0.592 . . . . 73.3 110.264 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.592 HD23 HD21 ' A' ' 43' ' ' LEU . 8.6 mt -73.41 -32.0 64.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.564 -0.744 . . . . 72.1 110.977 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.709 HG22 ' HB3' ' A' ' 15' ' ' LEU . 33.9 t -78.4 -42.86 26.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.323 -0.399 . . . . 61.21 111.022 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.7 m -60.56 -33.99 73.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.023 -0.535 . . . . 50.24 110.521 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.462 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -82.04 -22.7 36.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.046 -0.524 . . . . 74.14 110.954 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.821 ' HA ' HD21 ' A' ' 29' ' ' LEU . 38.9 t80 -83.83 -22.81 31.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.142 -0.481 . . . . 74.54 110.989 179.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -84.15 -54.28 4.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 73.43 111.219 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.462 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 2.0 p-80 -62.94 -26.22 68.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.987 -0.551 . . . . 74.11 111.18 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 1.054 HD12 HD23 ' A' ' 29' ' ' LEU . 3.0 tt -48.94 -42.83 38.65 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.951 0.405 . . . . 43.31 110.91 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -79.02 -39.03 35.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.859 -0.609 . . . . 75.4 110.499 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.02 -45.13 96.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.951 -0.568 . . . . 75.51 110.685 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.5 p -89.89 -4.58 57.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.903 -0.589 . . . . 74.42 111.373 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.47 36.46 16.85 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.797 0.332 . . . . 72.24 111.24 179.651 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.537 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 7.3 mmt180 -88.58 46.05 1.35 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.246 -0.434 . . . . 72.22 111.517 -179.495 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.468 ' CE1' HD22 ' A' ' 66' ' ' LEU . 93.3 m-85 -68.17 173.22 4.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.8 0.333 . . . . 75.43 110.791 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -71.67 142.55 49.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.28 -0.418 . . . . 64.33 110.899 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 174.02 38.7 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.693 -0.765 . . . . 62.24 112.57 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.3 m -132.26 -45.24 0.92 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.883 0.373 . . . . 63.42 111.027 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -64.15 -33.21 75.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.987 -0.551 . . . . 70.54 110.957 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.458 ' O ' HG23 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -112.26 120.77 42.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 55.05 110.966 179.978 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.458 HG23 ' O ' ' A' ' 77' ' ' SER . 28.2 pt -157.25 160.2 2.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 62.3 111.125 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 9.1 m -132.09 155.55 47.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 73.14 110.886 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -70.05 111.9 6.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.873 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -151.03 136.53 11.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 73.11 111.129 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.83 127.25 43.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 74.2 110.895 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -135.7 173.93 11.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 72.11 110.876 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 60.42 170.06 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 72.11 110.88 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.4 t 63.49 111.65 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 64.52 111.122 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -169.33 148.04 3.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 75.13 110.915 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -86.85 154.37 20.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 75.24 110.891 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 12.2 m -110.4 -30.96 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 74.22 111.131 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.4 mttp -77.47 63.16 2.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 74.42 110.924 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.7 mp 60.54 110.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.142 -0.481 . . . . 52.35 110.932 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -176.75 128.22 0.18 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 70.42 110.913 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 68.4 -69.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 72.35 110.991 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 61.79 155.5 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.005 -0.543 . . . . 64.42 110.877 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.6 pttt 43.67 66.0 5.14 Favored Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 116.105 -0.498 . . . . 44.24 111.446 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.27 141.18 31.78 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.556 2.171 . . . . 54.32 112.304 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -159.71 123.84 3.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 75.22 110.901 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -103.46 141.43 35.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 74.21 110.895 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.1 m -88.32 119.97 29.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.266 -0.425 . . . . 65.4 110.893 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.5 120.25 0.92 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 74.53 110.936 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.3 m 60.55 109.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 72.15 110.912 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -108.22 101.3 10.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 62.22 110.856 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -109.89 122.33 47.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 75.4 110.871 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 25.5 p -91.82 -33.33 15.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.209 -0.451 . . . . 55.53 110.873 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.773 HD22 ' HG3' ' A' ' 108' ' ' PRO . 31.2 mt 60.02 109.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 74.23 110.917 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -69.64 169.19 13.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 72.43 110.874 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 63.71 -80.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.154 -0.476 . . . . 65.02 110.977 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 147.41 66.84 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.757 -0.735 . . . . 64.32 112.52 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.773 ' HG3' HD22 ' A' ' 104' ' ' LEU . 56.6 Cg_endo -70.85 173.04 12.54 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.553 2.168 . . . . 71.45 112.278 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -57.41 -160.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.613 2.209 . . . . 54.22 112.225 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.438 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 4.1 mttt -108.24 29.78 7.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 74.3 110.945 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.453 ' CE2' ' HB2' ' A' ' 178' ' ' ALA . 39.4 p90 -153.79 160.68 42.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.279 -0.419 . . . . 73.01 110.91 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 79.9 m -128.93 103.5 7.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.132 -0.485 . . . . 74.14 110.897 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.404 ' HG2' ' N ' ' A' ' 114' ' ' SER . 5.3 tttt -103.14 144.27 31.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.317 -0.401 . . . . 70.32 111.045 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.498 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -139.44 120.36 14.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.161 -0.472 . . . . 73.25 110.905 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 30.6 t -75.36 106.36 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 74.25 111.288 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.498 HD22 ' O ' ' A' ' 114' ' ' SER . 3.9 mm? -80.75 -44.77 18.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 73.4 110.844 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -123.34 107.84 12.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.441 . . . . 75.11 111.049 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.5 mttm -62.44 139.58 58.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 71.22 110.803 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -106.66 -106.27 3.1 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.759 -0.734 . . . . 53.23 112.452 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -90.48 -43.8 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.965 0.412 . . . . 73.04 110.745 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.458 ' O ' HG23 ' A' ' 122' ' ' THR . 0.3 OUTLIER 72.26 38.92 0.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.918 -0.583 . . . . 73.4 110.763 -179.796 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.458 HG23 ' O ' ' A' ' 121' ' ' LYS . 0.8 OUTLIER -160.59 -44.76 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.007 -0.542 . . . . 64.22 110.785 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -85.17 106.32 16.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 75.23 110.873 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.4 ' CD1' ' O ' ' A' ' 122' ' ' THR . 18.2 m-85 -119.22 147.78 43.7 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.186 -0.461 . . . . 72.24 110.885 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.567 ' CB ' HG11 ' A' ' 166' ' ' VAL . 52.0 Cg_exo -54.33 127.99 28.19 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.579 2.186 . . . . 43.53 112.303 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.0 mmtm -103.21 147.35 27.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 75.51 110.882 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 11.5 mtpt -55.64 111.25 0.86 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 73.21 111.02 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 107.42 -16.37 37.98 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.759 -0.734 . . . . 74.11 112.693 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.76 136.78 32.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.803 0.335 . . . . 74.12 110.875 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.705 HG12 ' HG3' ' A' ' 165' ' ' LYS . 23.9 m -70.82 171.88 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.253 -0.43 . . . . 73.33 111.302 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.874 HG22 ' O ' ' A' ' 164' ' ' PHE . 19.9 m -156.63 145.47 11.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.773 -0.649 . . . . 75.34 110.529 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.573 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -127.2 117.83 23.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.683 0.278 . . . . 72.2 110.755 179.865 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.552 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.4 p -155.16 169.58 23.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.976 0.417 . . . . 74.33 111.216 -179.236 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.621 ' HB3' HD13 ' A' ' 149' ' ' ILE . 12.3 m95 -106.36 165.62 11.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.858 -0.61 . . . . 71.13 110.074 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.483 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 39.9 p90 -161.76 136.21 6.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.041 0.448 . . . . 71.54 111.837 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.849 HG21 HG11 ' A' ' 5' ' ' VAL . 1.9 m -122.77 108.8 13.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.728 -0.669 . . . . 73.32 110.19 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.672 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.15 146.02 18.11 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.573 -0.823 . . . . 75.23 113.55 -179.128 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.583 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -152.28 152.53 32.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.767 0.318 . . . . 70.32 110.575 179.771 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.885 HD21 HD12 ' A' ' 208' ' ' ILE . 14.5 mt -87.52 -177.51 5.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 74.44 110.972 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -56.87 -43.44 81.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.103 -0.498 . . . . 65.42 110.939 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.1 -9.77 59.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.997 -0.547 . . . . 71.22 111.249 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 100.91 25.83 8.26 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.669 -0.777 . . . . 62.41 112.52 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.14 108.73 17.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.775 0.321 . . . . 42.4 110.864 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.483 HG22 HG23 ' A' ' 138' ' ' THR . 39.0 t -63.67 126.4 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 74.43 111.111 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.682 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 51.7 p90 -111.83 -28.63 7.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 75.32 111.106 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -158.47 115.16 2.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.892 0.377 . . . . 74.33 111.084 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.674 HG23 HG23 ' A' ' 136' ' ' THR . 85.5 m -132.9 106.75 7.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 51.22 110.83 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.483 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 36.0 t30 -86.33 6.7 28.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.446 . . . . 72.24 111.552 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.621 HD13 ' HB3' ' A' ' 134' ' ' TRP . 12.4 mm -79.46 160.46 4.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.682 0.277 . . . . 72.41 110.661 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.502 ' N ' HG22 ' A' ' 149' ' ' ILE . 35.6 mm-40 -146.29 -85.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.462 -0.335 . . . . 54.34 111.055 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 21.4 p -146.69 166.08 27.66 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.843 0.354 . . . . 73.31 110.988 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' SER . . . . . 0.681 ' CB ' HG21 ' A' ' 12' ' ' VAL . 2.9 p -73.17 139.28 46.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 72.22 110.802 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -58.52 -28.61 65.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 72.0 111.231 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.31 -30.88 54.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 73.02 111.018 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 7.3 tttp -86.39 -33.46 20.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.27 -0.423 . . . . 74.04 110.999 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.93 175.38 13.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 75.34 110.858 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.12 30.53 4.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 72.55 110.892 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 23.5 m-20 -113.12 57.43 0.67 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 71.42 110.815 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.428 ' HB1' ' CH2' ' A' ' 134' ' ' TRP . . . -157.18 127.94 6.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.139 -0.482 . . . . 61.12 110.994 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -132.09 121.62 17.86 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 74.24 110.855 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.416 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 51.9 Cg_exo -54.67 150.7 34.72 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.396 2.064 . . . . 63.43 112.259 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 3.3 tt -77.89 121.13 23.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.217 -0.447 . . . . 75.25 110.49 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.652 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -99.25 121.73 41.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.945 0.402 . . . . 75.13 111.402 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.874 ' O ' HG22 ' A' ' 131' ' ' VAL . 14.7 p90 -149.25 141.02 23.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.989 -0.55 . . . . 74.32 110.652 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.705 ' HG3' HG12 ' A' ' 130' ' ' VAL . 36.2 mttp -78.07 138.04 38.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.988 0.423 . . . . 64.41 111.151 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.567 HG11 ' CB ' ' A' ' 125' ' ' PRO . 35.8 m -87.76 149.12 4.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.84 -0.618 . . . . 63.35 111.157 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.25 24.61 74.81 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.783 -0.723 . . . . 60.21 112.635 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.734 HG23 ' HG2' ' A' ' 170' ' ' LYS . 5.6 m -132.94 43.26 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.867 0.365 . . . . 73.32 111.037 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.2 36.38 5.41 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 121.151 -0.547 . . . . 73.41 113.168 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 170' ' ' LYS . . . . . 0.734 ' HG2' HG23 ' A' ' 168' ' ' VAL . 2.7 mmtm -82.47 -47.06 12.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.899 0.38 . . . . 75.3 110.997 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -119.07 -179.33 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.06 -0.518 . . . . 72.53 110.962 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.572 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -58.41 160.69 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.375 -0.375 . . . . 74.03 111.265 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -68.95 -27.91 66.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.198 -0.455 . . . . 73.05 111.259 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 174' ' ' GLY . . . . . 0.411 ' HA2' ' CE3' ' A' ' 196' ' ' TRP . . . -75.21 -37.46 42.37 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.595 -0.812 . . . . 53.14 111.98 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.691 ' CD1' HD11 ' A' ' 190' ' ' LEU . 1.8 t90 -77.86 -33.15 52.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.985 0.421 . . . . 60.44 111.033 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -63.22 -38.58 91.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.962 -0.563 . . . . 61.01 110.636 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 177' ' ' GLU . . . . . 0.429 ' O ' HG23 ' A' ' 181' ' ' THR . 2.8 mm-40 -75.5 -29.37 59.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.988 -0.551 . . . . 42.21 110.824 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.662 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -79.13 -61.94 1.85 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.436 . . . . 63.31 111.32 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.789 HD21 HG21 ' A' ' 218' ' ' VAL . 6.9 mt -53.77 -33.77 56.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.028 -0.533 . . . . 75.14 111.031 -179.753 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 49.3 tp -58.84 -28.17 65.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.368 -0.378 . . . . 74.31 110.825 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 181' ' ' THR . . . . . 0.429 HG23 ' O ' ' A' ' 177' ' ' GLU . 26.4 p -91.75 -2.96 56.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 71.3 111.404 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 1.1 ttp -77.7 156.63 30.55 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.79 0.329 . . . . 74.13 110.797 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -112.79 167.96 10.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 65.44 111.134 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 184' ' ' LYS . . . . . 0.442 ' HA ' HD22 ' A' ' 220' ' ' LEU . 3.9 tttp -68.16 126.48 29.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.961 -0.563 . . . . 72.41 111.034 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.67 33.14 71.16 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.759 -0.734 . . . . 63.02 112.683 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -118.34 148.76 42.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.793 0.33 . . . . 64.02 110.849 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -117.09 139.75 50.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.297 -0.411 . . . . 74.01 110.213 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -145.65 173.86 11.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.151 0.5 . . . . 74.42 111.866 -179.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.75 114.93 10.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.585 -0.734 . . . . 63.25 109.71 179.183 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.691 HD11 ' CD1' ' A' ' 175' ' ' TRP . 0.9 OUTLIER -126.11 141.87 51.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.501 . . . . 55.53 112.131 -178.948 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.565 ' HG3' HG23 ' A' ' 215' ' ' THR . 0.2 OUTLIER -116.76 112.89 21.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.556 -0.747 . . . . 71.1 110.236 179.345 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.466 HD11 ' CZ ' ' A' ' 216' ' ' PHE . 3.7 mp -101.09 143.48 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.971 0.415 . . . . 75.42 111.637 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.42 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.1 mt-10 -79.99 167.71 31.54 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 73.41 110.59 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 194' ' ' PRO . . . . . 0.42 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 18.8 Cg_endo -60.36 -44.03 30.55 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.45 2.1 . . . . 62.25 112.257 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.03 -25.27 11.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 73.23 111.296 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.438 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 7.4 m0 -118.02 36.95 4.13 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.472 -0.331 . . . . 53.22 111.097 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -155.25 -83.59 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 61.04 111.357 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 198' ' ' TYR . . . . . 0.491 ' HD2' HG21 ' A' ' 208' ' ' ILE . 35.6 m-85 -105.59 -27.91 11.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.898 0.38 . . . . 75.15 110.84 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 105.38 176.8 24.22 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.832 -0.699 . . . . 74.2 112.789 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -60.23 -34.65 73.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.79 0.328 . . . . 75.53 110.858 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -49.49 77.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 73.24 110.707 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.34 -158.65 14.21 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.839 -0.696 . . . . 52.44 112.605 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.451 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.0 OUTLIER -149.77 83.64 6.23 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 120.82 0.343 . . . . 63.14 110.518 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.39 -43.6 43.35 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.725 2.284 . . . . 73.51 112.727 -179.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.64 -42.13 70.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.889 0.376 . . . . 71.44 111.036 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.682 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -96.95 26.73 4.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.043 -0.526 . . . . 63.42 111.299 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.19 31.13 4.8 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.405 -0.361 . . . . 72.24 111.091 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.885 HD12 HD21 ' A' ' 139' ' ' LEU . 18.5 mm -95.72 111.72 56.71 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 74.22 111.19 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.29 161.3 43.19 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.407 2.071 . . . . 62.22 112.214 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_exo -51.62 118.62 4.6 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.489 2.126 . . . . 64.31 112.292 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 65.07 72.5 0.43 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.226 -0.443 . . . . 62.1 110.849 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -122.33 151.64 40.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 72.34 111.256 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 213' ' ' LYS . . . . . 0.523 ' O ' HD23 ' A' ' 214' ' ' LEU . 5.6 tptt -88.7 148.12 24.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.074 -0.512 . . . . 74.2 110.45 179.68 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.523 HD23 ' O ' ' A' ' 213' ' ' LYS . 8.2 mt -129.86 109.41 10.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.839 0.352 . . . . 73.34 111.363 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.565 HG23 ' HG3' ' A' ' 191' ' ' GLU . 58.5 m -106.97 138.92 42.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.062 -0.517 . . . . 71.31 110.786 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.672 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 9.0 p90 -161.8 -175.4 4.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.265 -0.425 . . . . 64.1 111.053 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 217' ' ' GLU . . . . . 0.457 ' HG2' ' HA ' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -144.65 147.96 33.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 73.32 110.807 -179.946 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.789 HG21 HD21 ' A' ' 179' ' ' LEU . 1.5 t -125.89 153.36 33.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.98 -0.555 . . . . 71.13 112.025 -178.192 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -133.93 106.11 7.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.846 -0.615 . . . . 74.54 110.031 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.621 HD21 ' CG1' ' A' ' 223' ' ' ILE . 1.3 tt -69.93 130.97 43.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.406 -0.361 . . . . 55.31 110.996 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 28.1 t -109.3 -29.72 2.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.17 -0.468 . . . . 74.55 111.466 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 222' ' ' ASP . . . . . 0.408 ' N ' HD23 ' A' ' 220' ' ' LEU . 4.0 t0 -171.11 161.67 6.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.869 0.366 . . . . 74.2 111.267 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.678 HG23 HG12 ' A' ' 131' ' ' VAL . 39.3 mt -141.96 111.45 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.087 -0.506 . . . . 74.04 110.99 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 74.4 110.899 179.979 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.843 0.354 . . . . 64.35 111.183 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.767 ' HB2' ' O ' ' A' ' 73' ' ' LYS . . . 61.14 154.99 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 62.24 111.081 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.36 24.72 1.92 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 54.2 111.254 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -173.99 168.44 4.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.842 0.353 . . . . 71.31 111.24 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 1.033 HG11 HG21 ' A' ' 136' ' ' THR . 60.1 t -124.02 116.09 27.49 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.102 -0.499 . . . . 73.14 111.063 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.446 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 72.0 Cg_endo -77.18 137.75 17.38 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.708 2.272 . . . . 75.21 112.456 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -82.35 148.1 28.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 72.44 110.76 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.89 97.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 71.34 111.207 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.95 -16.36 63.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.482 . . . . 51.41 111.397 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.451 ' CZ3' ' HA ' ' A' ' 25' ' ' ILE . 4.1 m-90 -129.44 161.87 29.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.948 0.404 . . . . 70.41 110.812 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.5 m -100.48 150.02 23.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.873 -0.603 . . . . 71.3 110.148 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.485 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 46.3 t -56.85 -36.84 51.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.958 0.409 . . . . 62.24 110.47 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.411 ' O ' ' HB2' ' A' ' 17' ' ' SER . 3.7 pt-20 -69.1 -22.71 63.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.814 -0.63 . . . . 55.25 110.852 179.366 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.434 ' O ' ' HB2' ' A' ' 17' ' ' SER . 26.0 mt-30 -82.03 -54.49 5.26 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.358 -0.383 . . . . 75.53 111.174 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.8 ' HB3' HG22 ' A' ' 60' ' ' VAL . 7.1 mt -50.11 -66.38 0.4 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 60.3 111.782 -179.208 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.485 ' HG2' ' O ' ' A' ' 12' ' ' VAL . 2.5 ptm180 -59.4 -25.23 64.12 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 120.957 -0.297 . . . . 74.44 111.242 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.434 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -52.03 179.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.919 0.39 . . . . 55.33 111.144 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -110.36 16.43 21.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.055 -0.521 . . . . 73.32 111.199 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.85 -23.75 8.48 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.497 -0.32 . . . . 74.42 111.184 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.918 HD12 HD11 ' A' ' 25' ' ' ILE . 1.2 tm? -80.67 117.2 66.78 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.454 -0.339 . . . . 74.12 110.856 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.546 ' HD2' HD22 ' A' ' 20' ' ' LEU . 37.3 Cg_endo -65.85 123.65 11.62 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.466 2.11 . . . . 72.22 112.425 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -27.82 69.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.112 -0.495 . . . . 62.23 111.278 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.462 ' HA ' HD12 ' A' ' 26' ' ' ILE . 3.0 ttpt -53.47 -39.51 64.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.909 0.385 . . . . 75.42 111.122 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.53 -53.65 9.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.059 -0.519 . . . . 41.25 110.658 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.918 HD11 HD12 ' A' ' 20' ' ' LEU . 36.2 mt -45.63 -33.63 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.799 -0.637 . . . . 71.01 111.342 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.747 ' HB ' HG23 ' A' ' 47' ' ' ILE . 6.0 mt -76.02 -40.21 37.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 61.02 111.037 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -69.43 -23.53 63.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.03 -0.532 . . . . 73.15 111.263 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.451 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 22.9 t80 -74.84 -46.4 36.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.964 0.411 . . . . 75.52 111.124 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.792 HD21 ' HA ' ' A' ' 63' ' ' TYR . 4.5 mt -69.03 -24.67 64.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.963 -0.562 . . . . 74.51 111.185 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.594 ' HA ' HD11 ' A' ' 38' ' ' LEU . 74.6 mt-30 -80.2 -28.37 38.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.387 -0.37 . . . . 73.14 110.98 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -94.29 -41.06 9.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.297 -0.41 . . . . 64.31 111.113 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.451 ' ND1' ' CZ ' ' A' ' 28' ' ' PHE . 11.7 m170 -90.3 -7.32 53.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.301 -0.408 . . . . 75.35 111.477 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.8 164.83 12.99 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.698 -0.763 . . . . 53.22 112.401 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.3 p -92.43 148.39 22.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.671 0.272 . . . . 74.25 110.614 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.604 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.5 OUTLIER -48.66 -57.08 6.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.785 0.326 . . . . 72.24 111.012 -179.804 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.65 -50.72 31.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 74.24 110.706 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.511 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 19.8 t80 -53.78 -47.97 70.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.751 -0.659 . . . . 72.2 110.287 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.712 HD21 ' O ' ' A' ' 29' ' ' LEU . 14.9 mt -63.83 -41.57 97.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.901 -0.591 . . . . 73.22 110.763 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.775 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.55 -40.21 18.35 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.2 -0.455 . . . . 71.45 111.095 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -48.59 -48.78 38.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.864 -0.607 . . . . 64.43 110.972 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.6 m80 -103.45 13.64 33.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 75.12 111.223 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 58.17 43.38 20.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.837 0.351 . . . . 64.15 110.894 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.735 HD13 HD13 ' A' ' 29' ' ' LEU . 20.4 mt -95.22 -20.91 18.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 70.02 111.615 -179.593 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.775 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -75.97 158.32 32.1 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.007 0.432 . . . . 44.41 111.127 -179.924 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.76 -124.23 6.1 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.978 -0.629 . . . . 73.44 112.42 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.894 ' O ' HG23 ' A' ' 50' ' ' VAL . 3.7 m120 -116.3 121.18 41.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.783 0.325 . . . . 74.01 110.945 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.747 HG23 ' HB ' ' A' ' 26' ' ' ILE . 2.4 mp -46.76 -50.53 5.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.223 -0.444 . . . . 55.54 111.335 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mttm -50.41 -38.64 43.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.923 -0.581 . . . . 73.54 110.753 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -85.57 -26.3 26.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.881 -0.599 . . . . 64.41 110.9 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.894 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.0 t -79.2 -26.22 12.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.28 -0.418 . . . . 74.22 111.313 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.01 -23.34 67.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.399 -0.364 . . . . 74.23 111.123 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -95.22 -28.06 15.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 61.45 110.9 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.02 33.64 2.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 72.4 110.918 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -159.54 124.51 4.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 13.42 110.962 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -83.85 171.09 13.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 71.12 110.755 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.777 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -55.27 -57.92 9.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.391 . . . . 75.21 110.599 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.32 -26.19 67.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.985 -0.552 . . . . 63.35 110.435 179.338 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -45.18 93.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.995 -0.548 . . . . 65.3 110.492 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.641 HD21 HG12 ' A' ' 26' ' ' ILE . 24.6 mt -74.68 -29.14 61.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.695 -0.684 . . . . 73.15 111.101 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.8 HG22 ' HB3' ' A' ' 15' ' ' LEU . 5.9 t -79.71 -43.52 23.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.972 0.415 . . . . 64.24 110.885 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.7 m -61.0 -34.99 75.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.911 -0.586 . . . . 70.54 110.761 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.451 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -81.33 -23.39 37.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 51.1 111.073 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.792 ' HA ' HD21 ' A' ' 29' ' ' LEU . 27.0 t80 -83.74 -22.79 31.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 73.41 110.945 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.1 m-20 -83.42 -54.61 4.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 73.24 111.39 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.511 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.3 p-80 -62.59 -25.79 68.26 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.114 -0.494 . . . . 62.43 111.327 -179.411 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.715 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.0 tt -53.25 -40.07 64.32 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.877 0.37 . . . . 71.41 110.935 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -78.71 -38.93 37.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.029 -0.532 . . . . 73.11 110.621 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.86 -41.26 91.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.023 -0.535 . . . . 73.4 110.772 179.834 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.9 p -90.85 -4.14 56.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.938 -0.574 . . . . 64.51 111.437 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.98 37.93 11.38 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.735 0.302 . . . . 73.32 111.351 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.425 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 27.0 mtt-85 -94.13 44.1 1.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.383 -0.371 . . . . 63.34 111.092 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.534 ' HA ' HD21 ' A' ' 66' ' ' LEU . 86.0 m-85 -64.32 177.75 0.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 71.23 110.832 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.767 ' O ' ' HB2' ' A' ' 2' ' ' ALA . 8.3 tttt -68.1 153.03 44.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 63.43 110.913 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -112.98 91.83 0.6 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.753 -0.737 . . . . 51.1 112.565 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.1 t 42.99 92.75 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.853 0.359 . . . . 64.32 111.559 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -134.72 -45.78 0.74 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 65.21 110.991 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.1 m -135.28 138.31 43.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.986 -0.552 . . . . 64.43 110.915 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 3.8 mp -113.24 -35.62 2.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 73.22 111.135 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.0 m -177.78 178.45 0.99 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 63.24 110.902 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -170.38 140.87 1.9 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.453 . . . . 74.51 110.895 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.474 HG12 ' N ' ' A' ' 82' ' ' SER . 21.5 t -132.45 158.81 43.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 62.31 111.096 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.474 ' N ' HG12 ' A' ' 81' ' ' VAL . 3.8 m -136.52 143.41 43.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 54.33 110.89 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -99.83 -41.18 7.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 74.52 110.892 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -87.31 136.32 32.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.99 -0.55 . . . . 55.42 110.918 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 28.4 t -122.78 124.66 71.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 74.31 111.078 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -140.89 -50.88 0.45 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 74.23 110.879 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -80.6 -32.03 36.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 51.23 110.926 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.5 t -86.55 89.82 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 73.11 111.153 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -141.9 90.37 2.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 75.23 110.872 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.5 tp -177.58 -39.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 72.03 110.958 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -79.85 -176.3 5.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.092 -0.504 . . . . 72.51 110.887 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -116.78 82.03 1.73 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 53.22 110.897 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -67.96 135.18 51.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 65.22 110.843 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.4 pttm -108.59 147.22 35.29 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 64.35 110.926 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.6 98.57 0.97 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.547 2.165 . . . . 74.11 112.331 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.7 tptt -159.85 145.35 15.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 55.44 110.869 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -136.11 79.16 1.75 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.147 -0.478 . . . . 72.24 110.891 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.7 p -152.86 163.27 40.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 73.32 110.914 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -104.81 -31.52 9.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 64.31 110.915 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -161.07 132.32 5.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 65.4 110.872 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -150.2 96.31 2.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 71.11 110.895 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -149.72 120.79 7.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 74.0 110.931 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.5 m 60.33 92.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 71.31 110.862 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -148.17 108.5 4.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 71.24 110.91 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -159.47 -45.08 0.05 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 74.25 110.897 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -159.46 78.27 0.71 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.075 -0.511 . . . . 73.22 110.888 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.25 88.45 1.91 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.714 -0.755 . . . . 44.42 112.498 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.94 170.81 15.92 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.532 2.155 . . . . 73.44 112.304 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.62 -178.87 2.49 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.583 2.188 . . . . 64.11 112.252 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.439 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 1.8 mptt -113.68 29.24 8.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 74.14 110.957 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.427 ' CE1' ' HB2' ' A' ' 177' ' ' GLU . 34.3 p90 -151.99 152.36 32.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.207 -0.451 . . . . 73.23 110.886 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 62.9 m -124.08 103.62 8.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 62.03 110.947 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt -97.09 151.34 19.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.445 . . . . 75.24 110.834 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.421 ' O ' HD22 ' A' ' 116' ' ' LEU . 1.4 t -148.69 118.62 7.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.248 -0.433 . . . . 72.34 111.018 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 40.7 t -78.62 106.33 9.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.461 . . . . 61.41 111.242 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.527 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -81.8 -41.26 21.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.419 . . . . 73.02 110.7 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 8.2 ttpp -125.51 109.15 12.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 61.45 111.008 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.4 mttp -61.14 139.44 58.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 74.44 110.937 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -97.33 -108.3 2.59 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.802 -0.713 . . . . 65.51 112.478 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -96.42 -37.32 10.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.967 0.413 . . . . 73.51 110.7 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.4 36.87 0.61 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.885 -0.598 . . . . 74.42 110.911 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 58.8 m -163.09 -43.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 71.34 111.086 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -81.81 86.05 6.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.286 -0.416 . . . . 74.32 111.158 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -102.74 143.36 26.45 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 75.42 110.743 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.633 ' HA ' HG21 ' A' ' 223' ' ' ILE . 52.7 Cg_exo -55.51 130.96 43.36 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.559 2.173 . . . . 74.51 112.575 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.12 147.31 24.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 72.11 110.735 179.786 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -53.3 116.94 2.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.329 -0.396 . . . . 75.52 111.139 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 93.8 -4.27 71.86 Favored Glycine 0 CA--C 1.519 0.326 0 C-N-CA 120.732 -0.747 . . . . 73.52 112.876 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.21 139.5 30.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.869 0.366 . . . . 70.0 110.972 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.613 HG12 ' O ' ' A' ' 224' ' ' ASP . 7.8 p -69.39 162.23 3.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 72.43 111.055 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.92 HG12 HG23 ' A' ' 223' ' ' ILE . 13.4 m -154.86 145.95 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 65.13 111.031 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.463 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -128.08 117.97 22.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.722 0.296 . . . . 74.55 110.951 179.909 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.447 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 22.9 p -151.36 166.76 30.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.92 0.39 . . . . 51.44 111.216 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.652 ' O ' HG13 ' A' ' 218' ' ' VAL . 15.8 m95 -100.93 160.9 13.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.017 -0.538 . . . . 71.43 109.961 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.486 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 17.4 p90 -161.28 138.1 8.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.917 0.389 . . . . 74.31 111.632 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' THR . . . . . 1.033 HG21 HG11 ' A' ' 5' ' ' VAL . 3.5 m -126.33 109.06 11.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.999 -0.546 . . . . 74.43 111.043 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.724 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -86.94 138.31 15.41 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.834 -0.698 . . . . 73.1 113.111 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.863 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.98 132.56 14.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.705 0.288 . . . . 50.44 110.522 179.547 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.494 HD21 HG23 ' A' ' 208' ' ' ILE . 40.8 mt -70.44 -178.37 1.73 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.381 -0.372 . . . . 74.03 110.991 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -57.15 -42.71 81.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.086 -0.507 . . . . 61.21 110.774 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -76.03 -3.08 33.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.935 -0.575 . . . . 71.12 111.493 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' GLY . . . . . 0.434 ' O ' HG22 ' A' ' 138' ' ' THR . . . 90.67 8.39 65.63 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.629 -0.796 . . . . 74.2 112.91 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.01 110.01 11.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.785 0.326 . . . . 72.14 110.684 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 137' ' ' GLY . 7.3 p -63.67 133.04 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.289 -0.414 . . . . 54.23 111.158 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.429 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 46.1 p90 -111.22 -29.3 7.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 72.03 110.832 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -168.21 121.8 0.9 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 64.5 110.866 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.674 ' OG1' HG23 ' A' ' 136' ' ' THR . 12.5 t -142.82 128.25 18.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.37 -0.377 . . . . 74.15 111.077 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.486 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 25.2 t-20 -89.14 53.29 2.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.096 -0.502 . . . . 65.2 110.631 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . 3.2 mt -146.42 109.46 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 52.1 111.394 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -169.9 139.19 1.87 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.257 -0.429 . . . . 73.43 111.01 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' THR . . . . . 0.503 HG22 ' HB2' ' A' ' 159' ' ' ALA . 75.8 p -146.48 90.97 1.99 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.157 -0.474 . . . . 75.41 110.878 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 77.2 p -83.92 165.47 18.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 72.22 110.922 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -73.44 -36.19 65.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 64.52 111.093 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.08 -31.43 70.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 63.42 110.898 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.18 1.72 43.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 71.1 111.401 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.8 29.58 16.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.834 0.35 . . . . 72.42 110.962 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 57.3 87.48 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.23 -0.441 . . . . 73.24 110.952 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 11.0 m-20 -146.78 104.2 3.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 73.22 110.891 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.503 ' HB2' HG22 ' A' ' 151' ' ' THR . . . -127.64 138.99 53.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 22.22 111.116 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 160' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 161' ' ' PRO . 23.4 mttm -138.52 134.69 17.54 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 70.11 110.776 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 160' ' ' LYS . 31.1 Cg_exo -58.76 152.18 58.7 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.378 2.052 . . . . 53.32 112.351 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.62 125.56 29.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 70.51 110.306 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.628 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.66 122.91 43.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.991 0.424 . . . . 73.44 111.585 -179.66 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.867 ' O ' HG22 ' A' ' 131' ' ' VAL . 6.6 p90 -151.31 143.62 24.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.859 -0.609 . . . . 74.32 110.516 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.583 ' O ' HG22 ' A' ' 168' ' ' VAL . 34.6 mttt -81.7 142.0 33.08 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 75.33 111.043 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.5 m -87.69 149.03 4.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.897 -0.592 . . . . 73.2 111.285 -179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 67.91 25.11 74.36 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.851 -0.69 . . . . 70.52 112.592 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.608 HG23 ' HG2' ' A' ' 170' ' ' LYS . 27.3 m -131.3 41.11 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.788 0.327 . . . . 73.24 111.174 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.22 35.25 2.49 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 121.194 -0.527 . . . . 72.12 113.151 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 170' ' ' LYS . . . . . 0.608 ' HG2' HG23 ' A' ' 168' ' ' VAL . 0.0 OUTLIER -83.69 -43.55 15.43 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.794 0.331 . . . . 64.33 111.178 -179.777 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 171' ' ' VAL . . . . . 0.434 HG22 ' CE2' ' A' ' 164' ' ' PHE . 2.8 m -119.14 179.38 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.166 -0.47 . . . . 61.44 111.147 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.56 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.4 163.61 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 73.41 111.217 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 173' ' ' ARG . . . . . 0.442 ' HD3' ' CZ2' ' A' ' 196' ' ' TRP . 14.7 ttm105 -70.13 -29.75 66.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.234 -0.439 . . . . 74.3 111.227 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.36 -36.49 49.86 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.603 -0.808 . . . . 74.11 112.02 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.79 ' HE1' HG21 ' A' ' 218' ' ' VAL . 1.7 t90 -79.76 -34.34 39.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.052 0.453 . . . . 73.52 110.874 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 176' ' ' ASP . . . . . 0.792 ' O ' HD13 ' A' ' 180' ' ' LEU . 14.8 t70 -62.82 -33.28 74.9 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.751 -0.659 . . . . 51.0 110.403 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 177' ' ' GLU . . . . . 0.427 ' HB2' ' CE1' ' A' ' 111' ' ' TYR . 3.9 mm-40 -80.77 -29.09 36.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.527 . . . . 71.13 110.68 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.504 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -78.8 -61.93 1.86 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.445 . . . . 73.23 111.175 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.712 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 10.1 mt -53.65 -28.14 31.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.967 -0.56 . . . . 55.25 110.794 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.792 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.1 tp -53.38 -29.75 36.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.115 -0.493 . . . . 53.54 111.272 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 60.2 p -108.87 7.7 26.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.382 -0.372 . . . . 64.22 111.7 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.422 ' O ' HD13 ' A' ' 220' ' ' LEU . 26.7 mmm -69.78 106.03 2.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.889 0.376 . . . . 70.33 110.884 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.09 150.25 48.46 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.969 -0.56 . . . . 74.14 111.036 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 184' ' ' LYS . . . . . 0.71 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -56.12 119.94 6.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.56 . . . . 62.02 110.9 -179.869 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 74.97 20.33 79.5 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.705 -0.76 . . . . 32.23 112.431 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -96.95 143.41 27.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.846 0.355 . . . . 63.23 111.081 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt -110.45 132.9 53.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.061 -0.518 . . . . 74.33 109.787 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -143.08 171.52 13.96 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.235 0.54 . . . . 74.34 112.09 -179.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 189' ' ' ARG . . . . . 0.449 ' HA ' ' HA ' ' A' ' 217' ' ' GLU . 0.0 OUTLIER -137.09 117.6 13.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.299 -0.864 . . . . 74.22 109.504 179.587 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.923 HD21 ' CE2' ' A' ' 216' ' ' PHE . 2.2 pt? -127.6 141.23 51.68 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.212 -0.595 . . . . 34.41 112.545 -178.791 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.724 ' HG3' HG23 ' A' ' 215' ' ' THR . 1.4 mp0 -113.59 116.12 29.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.271 -0.877 . . . . 74.24 109.864 179.034 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.425 HG12 ' CE1' ' A' ' 216' ' ' PHE . 4.5 mm -91.42 144.81 8.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.857 0.36 . . . . 60.41 111.372 -179.364 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -84.47 154.49 62.53 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.069 -0.514 . . . . 74.41 110.481 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 194' ' ' PRO . . . . . 0.415 ' O ' ' N ' ' A' ' 199' ' ' GLY . 63.7 Cg_exo -51.07 -44.2 43.76 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.458 2.105 . . . . 64.42 112.376 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -62.36 -19.74 63.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 74.02 111.629 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.442 ' CZ2' ' HD3' ' A' ' 173' ' ' ARG . 6.3 m0 -118.55 37.1 4.16 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.64 0.257 . . . . 71.5 111.528 -179.587 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -156.19 -84.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.634 -0.257 . . . . 74.34 111.581 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 198' ' ' TYR . . . . . 0.881 ' CE2' HD13 ' A' ' 208' ' ' ILE . 19.6 m-85 -104.96 -26.19 12.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.853 0.359 . . . . 74.41 111.061 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 199' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 194' ' ' PRO . . . 105.85 163.33 23.17 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.833 -0.699 . . . . 54.41 112.474 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 28.7 mtmt -55.49 -30.91 61.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.825 0.345 . . . . 75.53 110.824 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 18.8 mtpt -61.21 -48.53 81.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 73.14 110.795 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 106.72 166.32 22.53 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.836 -0.697 . . . . 34.04 112.487 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.841 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.7 OUTLIER -110.68 90.02 10.0 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.701 0.286 . . . . 62.44 110.832 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.17 -21.59 55.21 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.459 2.106 . . . . 73.54 112.409 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.46 -41.6 85.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.318 -0.401 . . . . 64.42 110.923 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -108.11 27.33 9.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.061 -0.518 . . . . 62.32 111.199 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 56.16 54.44 7.82 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.429 . . . . 73.44 111.108 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.881 HD13 ' CE2' ' A' ' 198' ' ' TYR . 27.1 mt -117.35 111.63 39.98 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 74.4 111.06 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 209' ' ' PRO . . . . . 0.41 ' HA ' ' HD3' ' A' ' 210' ' ' PRO . 38.4 Cg_exo -60.68 157.76 35.84 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.525 2.15 . . . . 55.41 112.373 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 210' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 209' ' ' PRO . 31.2 Cg_exo -61.17 130.52 32.67 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.651 2.234 . . . . 75.34 112.142 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 64.09 69.6 0.53 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.337 -0.392 . . . . 54.14 110.873 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -122.87 149.23 44.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.216 -0.447 . . . . 64.3 111.261 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 213' ' ' LYS . . . . . 0.9 ' O ' HD23 ' A' ' 214' ' ' LEU . 2.3 tttt -83.94 149.77 26.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.03 -0.532 . . . . 74.1 110.554 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.9 HD23 ' O ' ' A' ' 213' ' ' LYS . 7.2 mt -136.19 109.35 7.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.89 0.376 . . . . 54.11 111.576 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.724 HG23 ' HG3' ' A' ' 191' ' ' GLU . 45.7 m -109.95 138.23 46.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 71.14 110.184 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.923 ' CE2' HD21 ' A' ' 190' ' ' LEU . 12.4 p90 -157.79 120.36 3.83 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 112.386 0.513 . . . . 75.52 112.386 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 217' ' ' GLU . . . . . 0.449 ' HA ' ' HA ' ' A' ' 189' ' ' ARG . 2.6 mt-10 -74.17 136.46 42.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.628 -0.714 . . . . 64.14 110.654 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.79 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.3 t -122.41 150.89 26.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.077 -0.511 . . . . 75.35 111.525 -178.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -136.77 110.18 7.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.039 -0.528 . . . . 54.43 110.491 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.828 HD21 HG13 ' A' ' 223' ' ' ILE . 3.5 tt -70.53 132.16 45.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.404 -0.362 . . . . 74.3 111.145 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.408 HG21 ' HE1' ' A' ' 134' ' ' TRP . 30.8 t -109.68 -30.69 2.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.103 -0.499 . . . . 53.44 111.429 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 222' ' ' ASP . . . . . 0.423 ' N ' HD23 ' A' ' 220' ' ' LEU . 6.5 t70 -168.94 159.3 9.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.875 0.369 . . . . 75.24 111.107 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.92 HG23 HG12 ' A' ' 131' ' ' VAL . 29.2 mt -142.25 112.01 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 64.2 111.157 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 224' ' ' ASP . . . . . 0.613 ' O ' HG12 ' A' ' 130' ' ' VAL . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 73.33 110.826 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mtt . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.847 0.356 . . . . 63.42 111.163 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.15 132.99 49.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 34.31 111.05 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.576 ' O ' ' HB2' ' A' ' 4' ' ' ALA . . . 59.96 98.69 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.225 -0.443 . . . . 53.43 111.008 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.576 ' HB2' ' O ' ' A' ' 3' ' ' ALA . . . 167.07 89.57 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.209 -0.45 . . . . 72.45 111.105 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.954 HG11 HG21 ' A' ' 136' ' ' THR . 40.7 t -90.38 110.05 38.08 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.437 -0.347 . . . . 65.2 110.84 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.457 ' HB3' ' CE1' ' A' ' 32' ' ' HIS . 93.0 Cg_endo -79.21 135.06 11.88 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.533 2.155 . . . . 74.2 112.46 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -80.31 150.63 29.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.181 -0.463 . . . . 63.23 110.803 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.13 96.03 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.184 -0.462 . . . . 75.42 111.209 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.63 -16.46 64.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 74.13 111.396 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 6.0 m-90 -136.0 173.67 11.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.848 0.356 . . . . 73.34 110.789 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.449 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -116.79 152.11 35.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.113 -0.494 . . . . 74.13 110.597 179.776 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.417 ' CG1' ' HD2' ' A' ' 16' ' ' ARG . 38.2 t -55.88 -32.74 33.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.264 -0.425 . . . . 64.24 110.928 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -72.33 -26.65 62.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.992 -0.549 . . . . 73.25 111.202 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.449 ' HB2' HG23 ' A' ' 11' ' ' THR . 17.3 mt-30 -82.19 -56.44 3.92 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.842 0.353 . . . . 65.32 111.056 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.689 HD13 HG13 ' A' ' 60' ' ' VAL . 1.3 mt -49.58 -65.43 0.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.301 -0.409 . . . . 62.4 111.328 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.558 ' HG3' HG11 ' A' ' 60' ' ' VAL . 4.7 mtp-105 -55.75 -25.09 39.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 73.32 111.356 -179.73 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.412 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.1 OUTLIER -56.4 -179.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.01 0.434 . . . . 63.15 111.175 -179.799 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -109.41 16.76 22.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.937 -0.574 . . . . 60.41 111.108 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -114.51 -27.86 7.39 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.485 -0.325 . . . . 75.44 111.097 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.899 HD12 HD11 ' A' ' 25' ' ' ILE . 2.5 tm? -81.94 112.61 36.6 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.392 . . . . 53.11 110.954 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -60.66 123.34 12.82 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.52 2.146 . . . . 65.3 112.364 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -24.15 67.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 75.54 111.192 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -53.61 -40.53 65.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.886 0.374 . . . . 75.41 111.232 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.98 -52.5 14.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.092 -0.504 . . . . 71.42 110.728 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.899 HD11 HD12 ' A' ' 20' ' ' LEU . 42.8 mt -44.87 -30.74 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.707 -0.679 . . . . 73.2 111.295 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.795 ' HB ' HG23 ' A' ' 47' ' ' ILE . 7.3 mt -81.76 -55.2 8.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.053 0.454 . . . . 65.44 110.765 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.454 ' HG2' HD11 ' A' ' 47' ' ' ILE . 24.3 mttt -52.44 -27.12 14.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.687 -0.688 . . . . 74.42 110.935 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.454 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 42.7 t80 -77.24 -48.63 17.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.075 -0.511 . . . . 72.3 110.969 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.792 HD21 ' HA ' ' A' ' 63' ' ' TYR . 6.3 mt -67.13 -26.44 66.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.859 -0.609 . . . . 74.23 111.336 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -75.3 -35.66 61.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.942 0.401 . . . . 73.44 110.717 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.424 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 14.9 pt-20 -87.63 -31.19 19.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 70.04 111.075 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.457 ' CE1' ' HB3' ' A' ' 6' ' ' PRO . 19.7 m170 -98.95 -9.02 24.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.289 -0.414 . . . . 75.31 111.571 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -109.86 155.65 15.98 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.719 -0.753 . . . . 63.24 112.318 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.3 p -97.3 153.11 18.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.562 0.22 . . . . 62.31 110.539 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.817 ' HA ' HD12 ' A' ' 38' ' ' LEU . 0.8 OUTLIER -42.89 -48.57 5.84 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.847 0.356 . . . . 72.31 111.371 -179.702 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.6 m -52.85 -50.89 62.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.123 -0.489 . . . . 60.25 110.507 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.759 ' CZ ' HD12 ' A' ' 66' ' ' LEU . 1.1 t80 -60.47 -31.95 70.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.623 -0.717 . . . . 73.33 110.355 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.817 HD12 ' HA ' ' A' ' 35' ' ' ASP . 5.9 mt -75.86 -54.75 6.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.004 -0.543 . . . . 65.24 111.307 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.78 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -50.02 -35.0 23.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.351 -0.386 . . . . 63.55 111.751 -179.63 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -72.64 -31.13 64.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.242 -0.435 . . . . 65.51 111.523 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.437 ' CD2' ' CB ' ' A' ' 62' ' ' ALA . 2.7 m-70 -109.91 10.33 24.39 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.734 0.272 . . . . 62.52 111.734 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.407 ' N ' ' O ' ' A' ' 38' ' ' LEU . 7.7 mmmt 58.43 35.63 24.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.745 0.307 . . . . 62.12 111.217 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.695 ' CB ' HD23 ' A' ' 38' ' ' LEU . 49.4 mt -90.96 -16.93 27.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.427 -0.352 . . . . 75.31 111.017 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.78 HD11 ' HB2' ' A' ' 39' ' ' ALA . 56.7 mt -50.76 170.46 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.042 0.449 . . . . 61.11 111.32 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.23 -155.94 29.04 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.927 -0.654 . . . . 63.41 112.951 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.887 ' O ' HG23 ' A' ' 50' ' ' VAL . 72.9 m-80 -100.57 141.88 32.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.968 0.413 . . . . 74.14 111.051 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.795 HG23 ' HB ' ' A' ' 26' ' ' ILE . 2.9 mp -45.31 -47.24 3.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.883 -0.598 . . . . 73.11 111.526 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mttm -51.61 -41.58 61.34 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.983 -0.553 . . . . 61.21 111.065 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -85.7 -28.35 24.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.013 -0.54 . . . . 73.33 111.113 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.3 t -74.0 -27.72 22.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.278 -0.419 . . . . 75.52 111.535 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.45 -24.1 67.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.386 -0.37 . . . . 73.43 111.434 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -95.24 -27.3 15.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.341 -0.391 . . . . 71.51 111.28 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.7 m -84.19 -24.38 30.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.362 -0.381 . . . . 72.24 111.403 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -116.57 132.7 56.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.842 0.354 . . . . 50.55 111.31 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -79.71 -178.61 6.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.126 -0.488 . . . . 72.31 110.409 179.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.72 ' O ' HG23 ' A' ' 60' ' ' VAL . 22.8 mmmt -60.96 -58.46 8.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.788 0.328 . . . . 73.34 110.494 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.29 -30.18 71.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.211 -0.45 . . . . 75.14 110.512 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.35 -39.64 80.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.5 . . . . 71.45 110.443 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.595 HD21 HG12 ' A' ' 26' ' ' ILE . 30.5 mt -79.36 -27.36 41.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.588 -0.733 . . . . 53.35 111.022 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.72 HG23 ' O ' ' A' ' 56' ' ' LYS . 10.9 t -79.9 -44.26 22.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.969 0.414 . . . . 63.51 110.774 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 79.2 m -60.61 -35.8 77.02 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.896 -0.593 . . . . 63.15 110.236 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.437 ' CB ' ' CD2' ' A' ' 41' ' ' HIS . . . -78.7 -23.19 45.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.855 -0.611 . . . . 50.13 110.774 179.49 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.792 ' HA ' HD21 ' A' ' 29' ' ' LEU . 83.2 t80 -82.97 -22.74 33.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.086 -0.506 . . . . 75.41 111.016 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.434 ' ND2' HG12 ' A' ' 60' ' ' VAL . 39.0 m-80 -85.47 -53.73 5.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 75.44 111.242 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -24.35 67.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.008 -0.542 . . . . 63.45 111.408 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.759 HD12 ' CZ ' ' A' ' 37' ' ' PHE . 6.3 tt -56.06 -39.1 71.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.92 0.39 . . . . 75.41 110.904 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.402 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.4 m-85 -77.85 -40.69 39.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.975 -0.557 . . . . 64.11 110.613 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -66.37 -37.73 85.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.542 . . . . 65.24 110.711 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 75.5 p -91.13 -7.25 52.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.964 -0.562 . . . . 74.13 111.329 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.8 mtmt 51.21 35.43 13.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.739 0.304 . . . . 61.41 111.438 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 41.9 mtt-85 -91.93 44.4 1.17 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.374 -0.375 . . . . 73.42 111.146 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.403 ' CE2' ' HD2' ' A' ' 6' ' ' PRO . 88.9 m-85 -65.72 176.53 1.51 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.288 -0.414 . . . . 74.41 110.701 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -77.11 134.38 38.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 74.24 110.897 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -112.22 -146.24 10.02 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.738 -0.744 . . . . 71.05 112.454 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.5 t -100.01 147.63 25.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.812 0.339 . . . . 71.22 110.865 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -110.05 -33.43 6.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.445 . . . . 73.43 110.908 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.461 ' O ' HG23 ' A' ' 78' ' ' ILE . 11.4 t -173.74 129.0 0.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 70.15 110.919 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.461 HG23 ' O ' ' A' ' 77' ' ' SER . 2.5 pp -157.26 146.25 10.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 74.5 111.09 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.4 m 60.31 -169.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 75.03 110.876 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.97 101.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 74.52 110.883 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.9 p -109.22 -31.08 2.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.45 . . . . 54.43 111.098 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 53.1 p -60.76 -41.99 96.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 74.42 110.895 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 63.64 138.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.218 -0.446 . . . . 72.3 110.914 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 60.72 111.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.471 . . . . 52.54 110.918 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.4 t -127.93 130.25 69.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 75.44 111.129 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.66 -51.58 4.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.46 . . . . 62.13 110.869 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -177.48 -39.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 70.13 110.889 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 28.9 t -66.97 107.04 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.076 -0.511 . . . . 75.23 111.036 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 6.7 tptt -136.22 88.73 2.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 63.2 110.901 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.2 mp -88.49 164.09 15.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 72.4 110.897 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 60.44 107.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 72.41 110.902 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.79 -32.79 21.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 74.43 110.898 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -102.66 101.09 11.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 74.22 110.887 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.2 tttm -105.82 87.48 2.36 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 61.11 110.931 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.79 165.83 29.68 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.595 2.197 . . . . 65.1 112.293 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.24 128.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 73.23 110.946 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 61.02 31.91 19.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 60.54 110.929 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 5.6 m -163.73 105.08 0.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 71.32 110.911 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.3 mttt 60.55 172.92 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 74.22 110.914 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.1 p -152.78 147.22 25.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 64.05 110.871 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -96.55 -32.54 12.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 71.43 110.888 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 60.34 164.29 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 71.33 110.877 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 2.5 p -146.6 122.64 10.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 63.3 110.88 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 7.1 mt -95.21 134.05 38.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 72.52 110.918 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -93.32 179.46 5.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 75.42 110.884 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 63.71 -80.15 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.179 -0.464 . . . . 74.13 110.996 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 148.35 66.9 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.872 -0.68 . . . . 53.05 112.532 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.88 170.81 15.84 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.577 2.185 . . . . 73.42 112.306 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.07 -167.65 0.18 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.596 2.197 . . . . 64.24 112.29 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -100.76 29.9 4.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 64.11 110.955 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -154.82 167.33 30.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.285 -0.416 . . . . 73.42 111.015 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 82.0 m -136.72 103.52 5.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.016 -0.538 . . . . 75.51 110.725 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 190' ' ' LEU . 21.5 ptmt -108.14 151.45 25.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.948 0.404 . . . . 73.35 111.196 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.434 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.4 OUTLIER -142.49 123.16 14.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.952 -0.567 . . . . 74.32 110.547 179.829 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.609 ' O ' HG13 ' A' ' 115' ' ' VAL . 9.1 p -77.56 106.24 7.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.284 -0.417 . . . . 72.11 111.173 -179.834 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.5 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.5 mm? -77.73 -42.18 35.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 71.13 110.855 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.3 tttm -130.46 108.18 9.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 65.14 110.962 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 138.28 57.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 72.0 110.844 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.503 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -109.22 -156.19 17.01 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.631 -0.795 . . . . 75.22 112.645 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -36.53 -51.21 0.83 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.919 0.39 . . . . 73.4 111.651 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 66.99 34.58 5.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.836 -0.62 . . . . 75.55 110.296 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 55.1 m -151.88 -44.06 0.11 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.697 -0.683 . . . . 72.14 110.66 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -91.5 92.65 8.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 73.53 110.903 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -100.74 153.66 37.61 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 73.03 110.791 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.601 ' HB2' HG21 ' A' ' 166' ' ' VAL . 59.5 Cg_endo -71.88 125.55 11.12 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.52 2.147 . . . . 70.31 112.443 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.0 mtmm -95.54 156.9 16.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.113 -0.494 . . . . 73.24 110.956 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.8 mttp -57.88 118.71 5.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 74.33 110.865 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 99.24 -23.44 36.29 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.643 -0.789 . . . . 74.33 112.507 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.414 ' O ' HG22 ' A' ' 166' ' ' VAL . 3.5 m-20 -78.6 136.91 37.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.746 0.308 . . . . 73.11 110.738 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.599 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 17.1 m -73.12 173.46 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.107 0.479 . . . . 63.42 111.655 -179.778 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.683 HG12 HG23 ' A' ' 223' ' ' ILE . 19.4 m -156.78 145.87 11.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.507 -0.769 . . . . 73.31 110.568 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.617 ' CD2' ' HB3' ' A' ' 163' ' ' SER . 0.1 OUTLIER -126.16 117.72 23.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.639 0.257 . . . . 74.13 110.454 179.506 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.436 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.9 p -150.8 169.91 20.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.104 0.478 . . . . 54.31 111.512 -179.225 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' TRP . . . . . 0.511 ' O ' HG13 ' A' ' 218' ' ' VAL . 85.6 m95 -101.88 156.35 17.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.559 -0.746 . . . . 73.14 109.531 179.246 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.569 ' H ' HD11 ' A' ' 149' ' ' ILE . 31.8 p90 -161.27 137.66 8.34 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 120.314 -0.554 . . . . 74.21 112.304 -179.361 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.954 HG21 HG11 ' A' ' 5' ' ' VAL . 12.8 m -127.88 111.56 13.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.485 -0.779 . . . . 62.04 110.195 179.312 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' GLY . . . . . 0.555 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.52 145.54 17.88 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.577 -0.821 . . . . 74.01 113.13 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.738 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.6 OUTLIER -150.71 153.02 34.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.8 0.334 . . . . 62.14 110.893 179.834 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.618 HD12 ' HB ' ' A' ' 143' ' ' THR . 69.5 mt -92.07 179.23 5.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.01 110.757 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' GLN . . . . . 0.525 ' HA ' ' HB2' ' A' ' 3' ' ' ALA . 5.9 mm-40 -57.04 -44.4 82.9 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.961 0.41 . . . . 73.35 110.996 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.01 -8.54 56.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.968 -0.56 . . . . 70.53 111.313 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 95.94 25.81 12.47 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.644 -0.789 . . . . 54.44 112.523 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' THR . . . . . 0.618 ' HB ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -93.89 112.59 24.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.836 0.35 . . . . 72.31 110.777 179.977 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.434 HG12 HG23 ' A' ' 138' ' ' THR . 4.6 m -63.7 135.08 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 73.03 111.142 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.463 ' HB2' HD11 ' A' ' 208' ' ' ILE . 39.9 p90 -116.27 -39.39 3.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.49 . . . . 72.14 110.882 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -143.41 110.3 5.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.042 -0.526 . . . . 72.52 110.751 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.453 ' CG2' HG23 ' A' ' 136' ' ' THR . 67.3 m -142.82 107.57 4.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 73.42 111.138 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -97.74 35.42 1.69 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 73.25 110.477 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.569 HD11 ' H ' ' A' ' 135' ' ' TYR . 20.2 mm -100.79 104.49 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.08 -0.509 . . . . 72.44 111.095 -179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -107.32 -79.27 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 72.44 110.946 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 3.1 p -146.56 166.02 27.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.33 -0.395 . . . . 73.05 110.953 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.81 166.78 22.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.456 . . . . 74.12 110.878 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -80.91 -31.21 35.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 71.15 111.127 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt -63.85 -33.43 75.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 74.33 110.937 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.1 mttm -75.31 -32.99 61.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 75.3 110.884 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 5.5 tptt -172.69 167.91 5.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 64.35 110.872 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -99.48 30.62 3.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 72.4 110.992 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 21.4 m-20 -113.24 31.23 6.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.476 . . . . 71.34 110.86 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.22 129.84 7.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 74.11 111.056 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 6.5 mttm -146.38 149.53 37.97 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 63.31 110.959 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.07 155.73 68.16 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.603 2.202 . . . . 73.04 112.223 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.66 123.64 24.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 72.01 110.692 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.655 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.5 OUTLIER -104.81 124.5 49.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.895 0.378 . . . . 64.25 111.083 179.866 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 164' ' ' PHE . . . . . 0.713 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 16.3 p90 -151.26 142.14 22.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 75.13 110.906 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.599 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 33.0 mttt -74.24 133.75 42.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.431 . . . . 73.35 111.174 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 166' ' ' VAL . . . . . 0.601 HG21 ' HB2' ' A' ' 125' ' ' PRO . 35.0 m -87.76 149.35 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.863 -0.608 . . . . 74.54 111.085 -179.619 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 69.28 22.07 76.08 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.777 -0.725 . . . . 74.0 112.608 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 168' ' ' VAL . . . . . 0.588 HG21 ' CB ' ' A' ' 165' ' ' LYS . 11.8 m -132.38 44.16 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.904 0.383 . . . . 60.33 111.059 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.17 36.36 4.02 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.171 -0.537 . . . . 51.2 113.223 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.59 -47.1 14.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.96 0.409 . . . . 53.31 110.881 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 171' ' ' VAL . . . . . 0.42 HG22 ' CE1' ' A' ' 164' ' ' PHE . 0.0 OUTLIER -119.37 -178.66 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.98 -0.554 . . . . 73.11 110.895 179.778 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 172' ' ' ILE . . . . . 0.564 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 4.2 pt -58.16 159.58 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.333 -0.394 . . . . 72.34 111.143 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -68.56 -29.61 68.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.347 -0.388 . . . . 75.44 111.152 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -72.57 -38.39 57.55 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.542 -0.837 . . . . 73.34 111.888 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 175' ' ' TRP . . . . . 0.608 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.0 t90 -77.65 -32.54 53.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.865 0.365 . . . . 75.45 110.94 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -62.61 -34.46 77.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.08 -0.509 . . . . 53.32 110.305 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -78.41 -29.86 47.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.993 -0.549 . . . . 71.31 110.679 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 178' ' ' ALA . . . . . 0.538 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -78.78 -59.07 2.93 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.163 -0.472 . . . . 73.31 111.293 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.713 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 4.6 mt -57.83 -30.78 66.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.986 -0.552 . . . . 75.42 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 180' ' ' LEU . . . . . 0.413 ' HA ' ' HG2' ' A' ' 125' ' ' PRO . 34.4 tp -59.47 -31.01 68.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.39 -0.368 . . . . 73.13 110.84 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.86 1.78 56.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 63.11 111.358 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.48 150.43 36.66 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.834 0.349 . . . . 71.35 110.927 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.57 165.63 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.248 -0.433 . . . . 71.34 111.22 -179.706 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 184' ' ' LYS . . . . . 0.751 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.7 OUTLIER -61.03 117.93 6.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.998 -0.546 . . . . 64.42 110.764 179.859 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 185' ' ' GLY . . . . . 0.405 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 69.35 65.95 2.42 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.678 -0.772 . . . . 70.54 112.272 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 186' ' ' GLU . . . . . 0.503 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 28.0 tt0 -144.48 145.09 31.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.62 0.248 . . . . 75.01 110.403 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt -118.63 137.02 53.57 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.21 -0.293 . . . . 71.42 110.21 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.21 173.79 11.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.18 0.514 . . . . 71.41 111.966 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.73 125.32 22.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.479 -0.782 . . . . 72.04 109.607 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 190' ' ' LEU . . . . . 0.538 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.7 pt? -137.2 143.13 42.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.274 0.559 . . . . 52.1 112.352 -179.122 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 191' ' ' GLU . . . . . 0.857 ' HG2' HG23 ' A' ' 215' ' ' THR . 6.6 mt-10 -117.13 111.01 18.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.289 -0.868 . . . . 74.45 109.862 179.158 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 192' ' ' ILE . . . . . 0.449 HD12 HD11 ' A' ' 172' ' ' ILE . 23.5 mt -104.76 141.52 20.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.024 0.44 . . . . 72.21 111.657 -179.116 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -74.02 163.23 69.82 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.758 -0.656 . . . . 74.12 110.947 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 194' ' ' PRO . . . . . 0.437 ' HG3' ' N ' ' A' ' 212' ' ' ALA . 48.7 Cg_exo -56.33 -36.31 96.92 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.756 2.304 . . . . 72.13 112.382 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -57.26 -42.32 81.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.26 -0.427 . . . . 72.52 111.13 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 196' ' ' TRP . . . . . 0.445 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 20.2 m0 -97.58 36.92 1.43 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 74.15 110.933 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 197' ' ' ALA . . . . . 0.438 ' HA ' HG21 ' A' ' 172' ' ' ILE . . . -160.24 -79.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.989 -0.55 . . . . 73.41 110.587 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 198' ' ' TYR . . . . . 0.582 ' CD2' HD11 ' A' ' 214' ' ' LEU . 42.6 m-85 -105.86 -71.24 0.75 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 60.14 110.352 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.19 178.13 16.16 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.831 -0.7 . . . . 74.14 112.818 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.27 -33.51 67.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.879 0.371 . . . . 72.32 110.86 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.13 -57.02 14.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.107 -0.497 . . . . 72.42 110.633 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.17 170.19 25.02 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.862 -0.685 . . . . 75.13 112.548 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 203' ' ' GLN . . . . . 0.603 ' CB ' HD12 ' A' ' 208' ' ' ILE . 2.5 mm-40 -106.48 85.69 1.86 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.726 0.298 . . . . 74.23 110.698 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -63.4 -21.74 71.35 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.572 2.182 . . . . 52.12 112.554 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.59 -42.28 74.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.877 0.37 . . . . 75.24 110.876 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -97.67 28.21 3.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.096 -0.502 . . . . 71.11 111.306 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 56.01 36.51 27.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.394 -0.366 . . . . 73.3 111.013 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 208' ' ' ILE . . . . . 0.603 HD12 ' CB ' ' A' ' 203' ' ' GLN . 40.9 mt -103.94 114.24 64.69 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.151 -0.477 . . . . 70.44 111.045 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.66 171.72 10.41 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.442 2.095 . . . . 74.25 112.364 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.96 128.62 14.25 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.607 2.205 . . . . 72.41 112.426 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 211' ' ' ASN . . . . . 0.418 ' HA ' ' HG2' ' A' ' 194' ' ' PRO . 5.4 m120 64.26 69.79 0.51 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.127 -0.488 . . . . 71.13 111.0 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 212' ' ' ALA . . . . . 0.437 ' N ' ' HG3' ' A' ' 194' ' ' PRO . . . -127.85 124.91 38.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 65.54 111.493 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 213' ' ' LYS . . . . . 0.501 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.7 OUTLIER -65.19 153.94 39.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 74.55 110.365 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.582 HD11 ' CD2' ' A' ' 198' ' ' TYR . 8.5 mt -131.14 109.49 10.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.947 0.403 . . . . 71.24 111.842 -179.264 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 215' ' ' THR . . . . . 0.857 HG23 ' HG2' ' A' ' 191' ' ' GLU . 25.4 m -100.99 135.98 41.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 61.14 110.32 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 216' ' ' PHE . . . . . 0.555 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 21.1 p90 -153.96 173.46 15.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.112 0.482 . . . . 74.11 111.653 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -132.61 136.37 46.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.637 -0.71 . . . . 72.13 110.426 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 218' ' ' VAL . . . . . 0.608 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.1 t -123.83 151.49 28.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.07 0.462 . . . . 72.43 111.968 -178.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -136.83 110.71 8.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.696 -0.683 . . . . 72.24 110.292 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 220' ' ' LEU . . . . . 0.751 HD22 ' HA ' ' A' ' 184' ' ' LYS . 1.7 tt -70.05 131.08 43.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 72.02 111.102 -179.693 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 221' ' ' VAL . . . . . 0.41 HG23 ' HA ' ' A' ' 133' ' ' CYS . 20.1 t -110.34 -29.21 2.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.112 -0.494 . . . . 75.53 111.452 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 222' ' ' ASP . . . . . 0.413 ' N ' HD23 ' A' ' 220' ' ' LEU . 4.1 t70 -170.81 161.31 7.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.917 0.389 . . . . 74.42 111.069 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 223' ' ' ILE . . . . . 0.716 HG13 HD21 ' A' ' 220' ' ' LEU . 42.3 mt -141.02 111.01 3.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.078 -0.51 . . . . 73.33 111.116 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 224' ' ' ASP . . . . . 0.417 ' C ' HG22 ' A' ' 130' ' ' VAL . 1.5 t70 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 74.2 110.907 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.984 HG11 HG21 ' A' ' 136' ' ' THR . 38.5 t . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.667 0.27 . . . . 64.25 111.042 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.46 ' HB2' ' CE1' ' A' ' 32' ' ' HIS . 76.7 Cg_endo -77.75 137.35 15.98 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.564 2.176 . . . . 70.32 112.36 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.749 ' CD ' HD11 ' A' ' 149' ' ' ILE . 1.4 tp60 -82.41 153.66 25.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 75.31 110.87 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.8 119.91 5.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.219 -0.446 . . . . 63.54 111.072 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.498 ' HB2' ' NZ ' ' A' ' 187' ' ' LYS . . . -90.97 -34.22 15.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 42.45 110.988 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.567 ' NE1' HD11 ' A' ' 20' ' ' LEU . 1.4 m-90 -113.95 173.17 6.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.141 -0.482 . . . . 74.04 110.943 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.459 ' O ' HD12 ' A' ' 15' ' ' LEU . 4.1 m -118.4 154.5 32.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.018 -0.537 . . . . 74.51 110.719 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.408 HG13 ' CD ' ' A' ' 16' ' ' ARG . 93.1 t -57.47 -35.52 50.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.939 0.4 . . . . 73.23 110.65 179.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -70.19 -28.51 65.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 72.34 111.068 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -82.18 -56.79 3.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.871 0.367 . . . . 74.31 111.098 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.692 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.6 mt -49.6 -64.59 0.76 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.2 -0.454 . . . . 72.41 111.23 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.876 ' HD2' HG11 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -54.04 -25.48 21.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.49 . . . . 73.13 111.182 -179.897 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.7 173.95 0.08 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.957 0.408 . . . . 73.2 111.313 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -110.37 16.93 21.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.865 -0.607 . . . . 71.11 111.182 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -109.8 -20.83 12.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.544 -0.298 . . . . 54.34 111.218 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.763 HD22 HD11 ' A' ' 25' ' ' ILE . 10.4 tt -91.85 129.78 40.94 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.521 -0.309 . . . . 74.23 110.943 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.89 126.33 11.83 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.396 2.064 . . . . 72.45 112.309 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -24.11 67.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 72.23 111.178 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.553 ' HA ' HD12 ' A' ' 26' ' ' ILE . 26.0 mmtt -52.84 -39.25 62.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.359 -0.382 . . . . 73.54 111.374 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.39 -57.6 4.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.272 -0.422 . . . . 64.12 111.04 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.763 HD11 HD22 ' A' ' 20' ' ' LEU . 36.2 mt -44.8 -30.67 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.61 . . . . 65.11 111.479 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.662 ' HB ' HG23 ' A' ' 47' ' ' ILE . 7.1 mt -77.86 -37.33 23.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 74.12 111.008 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -75.37 -24.87 57.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.096 -0.502 . . . . 75.02 111.069 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.489 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 11.8 t80 -72.04 -44.98 62.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.971 0.415 . . . . 63.54 110.837 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.753 HD13 HD13 ' A' ' 43' ' ' LEU . 6.3 mt -68.93 -27.49 65.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 72.32 110.981 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -75.39 -26.57 58.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.271 -0.422 . . . . 70.15 111.127 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.401 ' OE2' ' CD2' ' A' ' 32' ' ' HIS . 0.6 OUTLIER -100.94 -7.2 23.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.413 -0.358 . . . . 71.34 111.317 179.953 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.489 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 10.4 m170 -118.88 -8.73 10.24 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.63 -0.259 . . . . 63.04 111.371 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -123.64 164.74 16.66 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.782 -0.723 . . . . 41.42 112.375 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.7 p -93.21 156.94 16.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.635 0.255 . . . . 71.24 110.535 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.679 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.8 p-10 -48.18 -55.4 10.5 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.745 0.307 . . . . 74.14 111.086 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.7 m -50.47 -48.14 56.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.023 0.439 . . . . 74.34 110.786 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.91 ' CZ ' HD12 ' A' ' 66' ' ' LEU . 1.6 t80 -55.83 -48.66 75.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.842 -0.617 . . . . 75.21 110.44 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.429 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 13.2 mt -66.47 -42.85 86.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.007 -0.542 . . . . 72.21 110.798 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.798 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.39 -41.87 20.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.098 0.475 . . . . 65.31 110.969 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -49.37 -51.44 34.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.623 -0.717 . . . . 74.24 111.062 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -99.95 13.22 34.65 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.98 -0.555 . . . . 70.44 111.287 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt 55.91 41.81 29.54 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.86 0.362 . . . . 74.31 110.862 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.753 HD13 HD13 ' A' ' 29' ' ' LEU . 23.3 mt -92.51 -20.45 20.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.073 -0.512 . . . . 50.31 111.491 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.798 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -80.19 157.72 26.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.122 0.487 . . . . 74.34 111.171 -179.741 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.72 -119.9 4.65 Favored Glycine 0 N--CA 1.451 -0.357 0 CA-C-N 115.608 -0.724 . . . . 61.13 112.417 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.883 ' O ' HG23 ' A' ' 50' ' ' VAL . 17.4 m-80 -116.36 115.14 25.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.72 0.295 . . . . 70.25 110.947 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.662 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.75 -57.22 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.248 -0.433 . . . . 72.11 111.365 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.3 mttt -46.71 -37.23 8.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.87 -0.604 . . . . 65.53 110.944 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -85.7 -26.24 26.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.97 -0.559 . . . . 74.2 111.019 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.6 t -81.21 -26.0 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.411 . . . . 51.11 111.371 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.63 -15.69 63.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.436 -0.347 . . . . 51.45 111.164 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.9 ttpp -95.12 -31.32 13.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.307 -0.406 . . . . 75.33 110.919 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.11 -33.63 17.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 65.43 111.142 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.68 127.25 38.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.264 -0.425 . . . . 52.23 111.163 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -83.49 175.89 9.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 73.55 110.663 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.586 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -58.21 -58.12 9.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.88 0.372 . . . . 75.35 110.595 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.43 -27.81 69.55 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.035 -0.529 . . . . 72.31 110.594 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.1 -43.88 98.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.105 -0.498 . . . . 62.43 110.511 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.648 HD21 HG12 ' A' ' 26' ' ' ILE . 21.1 mt -71.59 -34.45 69.9 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.693 -0.685 . . . . 64.02 111.06 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.876 HG11 ' HD2' ' A' ' 16' ' ' ARG . 11.1 t -76.4 -41.9 35.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.017 0.437 . . . . 63.34 110.922 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.7 m -60.54 -34.26 73.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.892 -0.595 . . . . 73.2 110.654 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.428 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -81.02 -22.12 39.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 74.31 111.138 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.682 ' HA ' HD21 ' A' ' 29' ' ' LEU . 32.4 t80 -83.59 -22.84 32.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.295 -0.412 . . . . 62.31 111.079 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 41.9 m-20 -84.46 -54.24 4.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 71.42 111.49 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 3.1 p-80 -62.08 -32.9 73.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.073 -0.512 . . . . 63.23 111.288 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.91 HD12 ' CZ ' ' A' ' 37' ' ' PHE . 8.3 tt -47.69 -40.52 20.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.887 0.375 . . . . 74.43 111.201 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -78.14 -38.06 44.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.061 -0.518 . . . . 70.02 110.598 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.77 -38.45 86.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.992 -0.549 . . . . 61.15 110.823 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.1 p -87.85 -7.08 57.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 75.51 111.526 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.46 ' HZ2' ' HE1' ' A' ' 72' ' ' PHE . 0.8 OUTLIER 47.65 41.13 13.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.707 0.289 . . . . 70.5 111.556 179.61 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -107.34 46.04 0.96 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.91 0.386 . . . . 72.05 110.845 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.647 ' CD2' HD21 ' A' ' 66' ' ' LEU . 88.3 m-85 -60.58 179.07 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.014 -0.539 . . . . 74.4 110.741 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 41.2 tttm . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 61.13 110.798 179.907 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 19.8 mttt . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.81 0.338 . . . . 74.31 111.0 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.0 p90 -165.68 166.86 17.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 75.35 110.906 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . 0.456 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 0.3 OUTLIER -134.03 127.66 32.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.479 . . . . 71.42 110.546 179.807 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.01 144.51 49.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.951 0.405 . . . . 74.21 111.231 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.443 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.3 m -143.16 115.34 8.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.004 -0.544 . . . . 63.42 110.71 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 24.2 t -74.61 106.27 4.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.292 -0.413 . . . . 74.33 111.331 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.443 HD12 ' O ' ' A' ' 114' ' ' SER . 6.0 mp -74.04 -63.06 1.3 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 72.45 110.758 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.6 108.07 16.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 70.23 110.878 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.78 140.79 54.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.222 -0.445 . . . . 75.35 110.98 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.509 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -112.37 -154.38 12.17 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.795 -0.717 . . . . 74.33 112.404 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -36.8 -51.9 0.9 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.956 0.408 . . . . 73.3 111.446 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.7 tttm 69.69 35.64 2.34 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.908 -0.587 . . . . 73.12 110.197 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.27 -44.76 0.09 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.702 -0.681 . . . . 73.22 110.724 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -89.08 89.44 7.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 63.42 110.843 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -97.61 154.72 37.83 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.479 . . . . 75.04 110.909 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.79 ' HB2' HG21 ' A' ' 166' ' ' VAL . 56.4 Cg_endo -70.41 125.59 11.97 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.577 2.185 . . . . 52.13 112.356 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -99.75 153.22 19.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 74.11 110.914 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.55 116.9 5.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.245 -0.434 . . . . 75.31 110.856 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 107.42 -23.21 27.21 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.715 -0.755 . . . . 71.42 112.517 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.38 139.73 30.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.771 0.319 . . . . 74.25 110.732 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.612 HG12 ' HG3' ' A' ' 165' ' ' LYS . 16.9 m -70.84 174.32 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.035 0.445 . . . . 75.52 111.432 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.874 HG22 ' O ' ' A' ' 164' ' ' PHE . 20.7 m -157.51 145.49 10.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.66 -0.7 . . . . 64.04 110.387 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.465 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.22 117.72 22.88 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.722 0.296 . . . . 75.42 110.683 179.815 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.491 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 27.3 p -155.2 170.86 20.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.027 0.441 . . . . 62.22 111.191 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.811 ' HB3' HD13 ' A' ' 149' ' ' ILE . 8.8 m95 -106.37 163.64 12.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.84 -0.618 . . . . 75.11 110.21 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.465 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 35.8 p90 -160.97 135.18 7.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.129 0.49 . . . . 71.41 111.751 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.984 HG21 HG11 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -124.41 110.7 14.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.612 -0.722 . . . . 74.53 110.137 179.421 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.611 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.61 144.27 17.07 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.565 -0.826 . . . . 71.32 113.468 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.844 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -151.72 130.26 12.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.681 0.277 . . . . 52.14 110.385 179.596 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.633 HD12 ' HB ' ' A' ' 143' ' ' THR . 35.3 mt -60.93 -178.32 0.1 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.445 -0.343 . . . . 73.32 110.841 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -56.04 -41.48 75.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 74.23 110.746 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -83.56 -0.57 50.94 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.979 -0.555 . . . . 75.03 111.474 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 93.79 25.79 16.75 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.64 -0.791 . . . . 62.31 112.637 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . 0.633 ' HB ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -81.12 111.48 17.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.76 0.314 . . . . 72.21 110.874 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.425 HG21 ' HE3' ' A' ' 70' ' ' LYS . 34.9 t -65.59 120.91 13.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 61.2 111.17 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.443 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 35.2 p90 -112.13 -24.71 9.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 75.45 111.06 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . 0.414 ' HB2' ' CE1' ' A' ' 145' ' ' PHE . 28.9 m-20 -161.89 113.37 1.69 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.427 -0.351 . . . . 74.51 110.94 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.962 HG23 HG23 ' A' ' 136' ' ' THR . 90.0 m -125.29 105.58 9.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 73.42 111.04 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.465 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 19.7 t30 -88.73 -0.62 57.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 73.31 111.27 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.811 HD13 ' HB3' ' A' ' 134' ' ' TRP . 21.7 mm . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.757 0.313 . . . . 72.14 110.913 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.775 0.321 . . . . 54.34 111.094 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -146.38 112.53 4.37 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 52.55 110.844 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . 0.426 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 67.1 Cg_exo -51.01 154.02 7.97 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.422 2.081 . . . . 72.42 112.328 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.428 HD23 ' HD1' ' A' ' 164' ' ' PHE . 3.2 tt -78.35 122.37 25.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 65.01 110.522 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.67 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -100.42 121.35 41.4 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.94 0.4 . . . . 74.54 111.236 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.874 ' O ' HG22 ' A' ' 131' ' ' VAL . 10.1 p90 -150.1 141.74 23.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.98 -0.555 . . . . 74.31 110.731 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.612 ' HG3' HG12 ' A' ' 130' ' ' VAL . 72.6 mttt -77.33 136.63 38.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.083 0.468 . . . . 75.23 111.201 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.79 HG21 ' HB2' ' A' ' 125' ' ' PRO . 32.0 m -87.64 149.38 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.704 -0.68 . . . . 73.54 111.185 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.83 24.09 75.65 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.912 -0.661 . . . . 73.21 112.673 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.785 HG23 ' HG2' ' A' ' 170' ' ' LYS . 14.4 m -132.27 44.77 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.914 0.388 . . . . 61.13 111.043 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.7 36.39 4.67 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 121.188 -0.529 . . . . 72.52 113.215 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . 0.785 ' HG2' HG23 ' A' ' 168' ' ' VAL . 3.0 mmtm -82.99 -47.11 12.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.941 0.401 . . . . 61.21 110.983 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -118.3 -179.65 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.963 -0.562 . . . . 75.2 110.992 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.542 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -58.82 159.54 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 75.33 111.23 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -68.25 -26.1 65.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 71.44 111.297 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -77.84 -37.06 30.75 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.669 -0.777 . . . . 51.13 112.198 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.599 ' CD1' HD11 ' A' ' 190' ' ' LEU . 2.4 t90 -77.3 -33.57 55.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.897 0.38 . . . . 73.33 111.17 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.96 -37.16 83.76 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.016 -0.538 . . . . 74.14 110.617 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -73.27 -30.07 63.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.016 -0.538 . . . . 64.51 110.731 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.736 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -83.4 -48.82 9.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.147 -0.479 . . . . 62.31 111.249 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.57 HD21 HG21 ' A' ' 218' ' ' VAL . 9.4 mt -63.47 -34.42 77.72 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.074 -0.512 . . . . 61.45 110.801 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 35.6 tp -55.71 -23.12 27.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 74.42 111.115 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 51.1 p -98.64 2.25 47.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.368 -0.378 . . . . 61.21 111.567 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.413 ' HE1' ' O ' ' A' ' 186' ' ' GLU . 0.0 OUTLIER -77.19 152.39 34.82 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.729 0.299 . . . . 65.44 110.737 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -115.43 161.99 17.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.31 -0.405 . . . . 45.31 111.259 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -60.05 122.51 14.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.94 -0.573 . . . . 74.31 110.461 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 66.72 60.41 6.19 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.556 -0.83 . . . . 54.52 112.373 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . 0.509 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 17.1 tt0 -141.58 148.28 39.03 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.306 -0.257 . . . . 74.34 110.306 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . 0.498 ' NZ ' ' HB2' ' A' ' 9' ' ' ALA . 9.9 ttpt -117.26 135.61 53.69 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.184 -0.302 . . . . 74.31 110.184 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.73 168.9 18.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.126 0.489 . . . . 75.44 111.809 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.72 101.11 4.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.597 -0.729 . . . . 75.44 109.711 179.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.749 HD12 HD11 ' A' ' 192' ' ' ILE . 0.3 OUTLIER -115.34 143.91 44.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.101 0.477 . . . . 74.01 112.06 -178.853 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.687 ' HB3' HG23 ' A' ' 215' ' ' THR . 8.3 pt-20 -118.0 115.07 24.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.603 -0.726 . . . . 74.25 110.531 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.749 HD11 HD12 ' A' ' 190' ' ' LEU . 3.3 mp -96.93 134.79 33.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 74.04 111.247 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -70.89 166.1 40.66 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.912 -0.586 . . . . 73.33 110.808 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.94 -14.42 44.44 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.579 2.186 . . . . 64.32 112.604 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -79.64 -25.71 41.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.68 0.276 . . . . 70.34 111.245 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . . . . . . . . . 12.8 m0 -117.1 37.08 3.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.452 -0.34 . . . . 72.01 111.277 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -145.97 -83.46 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.353 -0.385 . . . . 70.24 111.356 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . 0.639 ' CE2' HD13 ' A' ' 208' ' ' ILE . 15.8 m-85 -109.43 -34.5 6.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.901 0.381 . . . . 62.33 110.875 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 118.18 170.02 14.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.85 -0.69 . . . . 72.1 112.577 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.89 -29.0 62.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.806 0.336 . . . . 64.12 110.926 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -66.67 -50.69 62.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.224 -0.444 . . . . 73.25 110.856 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 115.31 -162.66 12.4 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.87 -0.681 . . . . 54.11 112.468 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.547 ' HB3' HD12 ' A' ' 208' ' ' ILE . 1.2 tm0? -137.0 77.65 42.78 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.891 0.377 . . . . 52.43 110.863 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.61 -23.23 24.91 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.625 2.216 . . . . 55.42 112.422 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.96 -41.89 79.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.298 -0.41 . . . . 74.01 111.046 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.96 30.4 6.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.088 -0.506 . . . . 73.11 111.126 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.32 35.67 25.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 73.02 110.918 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.639 HD13 ' CE2' ' A' ' 198' ' ' TYR . 32.0 mt -98.53 111.74 60.78 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.454 . . . . 75.34 111.095 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.13 171.11 15.48 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.478 2.119 . . . . 54.41 112.373 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.56 142.12 69.93 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.586 2.19 . . . . 73.21 112.265 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 54.18 69.44 0.72 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.208 -0.451 . . . . 64.22 111.024 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . 0.516 ' HB1' HD22 ' A' ' 139' ' ' LEU . . . -122.43 115.02 21.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 63.32 111.466 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -65.35 131.49 46.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.043 -0.526 . . . . 75.53 110.452 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.512 HD11 ' CE2' ' A' ' 198' ' ' TYR . 4.9 mt -113.58 109.41 18.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.896 0.379 . . . . 64.34 111.68 -179.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.687 HG23 ' HB3' ' A' ' 191' ' ' GLU . 2.8 m -109.59 140.1 43.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.546 . . . . 73.13 110.417 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.611 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 4.7 p90 -156.32 -179.29 8.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.013 0.435 . . . . 72.54 111.387 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -134.34 137.65 44.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.721 -0.672 . . . . 74.44 110.432 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.573 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.7 t -120.32 151.76 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.99 0.424 . . . . 63.32 111.997 -179.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -136.33 105.87 6.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.777 -0.647 . . . . 72.1 110.221 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.552 HD21 ' CG1' ' A' ' 223' ' ' ILE . 1.0 OUTLIER -69.96 129.5 39.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.343 -0.39 . . . . 70.33 110.845 -179.755 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 33.7 t -108.24 -28.99 2.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.266 -0.424 . . . . 65.3 111.426 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -171.18 162.23 6.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.839 0.352 . . . . 60.14 111.024 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.644 HG23 HG12 ' A' ' 131' ' ' VAL . 46.5 mt -140.75 111.16 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 61.22 111.135 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . 0.589 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 64.31 110.817 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.892 HG11 HG21 ' A' ' 136' ' ' THR . 49.1 t . . . . . 0 CA--C 1.529 0.148 0 CA-C-O 120.611 0.243 . . . . 52.13 110.952 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.426 ' HD2' ' CE1' ' A' ' 72' ' ' PHE . 85.6 Cg_endo -80.46 145.46 16.67 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.632 2.221 . . . . 70.3 112.426 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -81.28 149.72 28.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.267 -0.424 . . . . 74.23 110.884 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.63 98.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 70.42 111.33 -179.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.429 ' HB2' ' HE3' ' A' ' 187' ' ' LYS . . . -68.58 -19.19 64.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.983 -0.553 . . . . 63.44 111.391 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.599 ' CD1' HD11 ' A' ' 20' ' ' LEU . 2.9 m-90 -136.99 173.89 11.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.96 0.409 . . . . 74.13 110.914 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.45 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.1 OUTLIER -115.64 150.89 35.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.871 -0.604 . . . . 70.25 110.475 179.673 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.541 HG12 ' HD2' ' A' ' 16' ' ' ARG . 32.7 t -56.11 -32.01 32.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.929 0.395 . . . . 72.55 110.818 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -73.98 -26.29 60.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.959 -0.564 . . . . 71.41 111.21 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.45 ' HB2' HG23 ' A' ' 11' ' ' THR . 6.2 mm100 -82.26 -57.27 3.45 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.892 0.377 . . . . 73.0 111.095 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.754 ' HB3' HG22 ' A' ' 60' ' ' VAL . 3.5 mt -49.67 -63.46 1.1 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.153 -0.476 . . . . 64.55 111.158 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.541 ' HD2' HG12 ' A' ' 12' ' ' VAL . 19.7 mtt180 -54.34 -24.42 19.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.125 -0.489 . . . . 65.24 111.217 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.08 176.97 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.944 0.402 . . . . 75.02 111.115 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -110.35 16.69 21.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.941 -0.572 . . . . 73.01 111.13 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -108.34 -28.02 9.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.519 -0.31 . . . . 74.54 111.093 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.599 HD11 ' CD1' ' A' ' 10' ' ' TRP . 7.0 tt -85.9 113.11 49.8 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.334 -0.393 . . . . 71.24 110.967 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -56.39 123.96 15.11 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.401 2.067 . . . . 72.13 112.172 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -24.11 65.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 74.44 111.089 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.7 mmtp -53.7 -33.59 55.96 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.281 -0.418 . . . . 65.12 111.332 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -78.76 -51.87 9.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.966 0.413 . . . . 71.41 110.998 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.552 HD11 HD22 ' A' ' 20' ' ' LEU . 31.1 mt -46.82 -33.17 2.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.896 -0.593 . . . . 74.44 111.311 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.668 HG12 HD21 ' A' ' 59' ' ' LEU . 12.1 mt -74.95 -52.94 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.084 0.468 . . . . 74.53 111.015 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.684 ' HG3' HD11 ' A' ' 47' ' ' ILE . 0.1 OUTLIER -57.01 -22.8 41.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.752 -0.658 . . . . 75.04 111.323 -179.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -75.08 -49.37 19.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.966 0.413 . . . . 55.12 110.851 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.891 HD23 HD12 ' A' ' 66' ' ' LEU . 4.3 mt -65.5 -26.63 68.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.914 -0.585 . . . . 75.22 110.938 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -81.27 -27.03 35.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.295 -0.411 . . . . 70.15 111.038 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.426 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -97.09 -6.13 35.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.492 -0.322 . . . . 75.25 111.198 179.714 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.426 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 92.2 m-70 -128.4 -3.23 5.52 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.346 . . . . 70.42 111.484 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.65 157.21 15.58 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.711 -0.757 . . . . 74.41 112.289 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.4 p -92.66 149.89 21.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.624 0.25 . . . . 65.44 110.625 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.938 ' HA ' HD12 ' A' ' 38' ' ' LEU . 0.6 OUTLIER -44.15 -49.77 8.9 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.405 -0.361 . . . . 74.12 111.49 -179.796 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.6 p -55.03 -47.42 74.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.008 0.433 . . . . 55.12 110.506 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.492 ' CE2' ' CE1' ' A' ' 65' ' ' HIS . 4.1 t80 -58.13 -44.12 87.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.692 . . . . 72.41 110.703 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.938 HD12 ' HA ' ' A' ' 35' ' ' ASP . 3.1 mt -63.57 -49.19 74.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.256 -0.429 . . . . 71.04 110.895 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.829 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -49.2 -28.19 4.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.115 -0.493 . . . . 64.14 111.349 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -77.43 -33.1 54.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 60.12 111.218 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.684 ' ND1' ' HB2' ' A' ' 62' ' ' ALA . 6.3 m-70 -108.78 10.42 26.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.395 -0.366 . . . . 74.24 111.58 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' A' ' 38' ' ' LEU . 12.8 mttp 60.21 31.86 20.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.779 0.323 . . . . 65.23 110.992 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.618 HD11 ' HB1' ' A' ' 62' ' ' ALA . 64.5 mt -84.56 -21.12 30.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 73.31 111.054 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.829 HD11 ' HB2' ' A' ' 39' ' ' ALA . 61.7 mt -48.75 170.34 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.944 0.402 . . . . 64.03 111.104 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.27 -163.39 34.26 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.784 -0.722 . . . . 62.41 112.78 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.884 ' O ' HG23 ' A' ' 50' ' ' VAL . 1.7 t-20 -102.85 148.77 25.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.88 0.372 . . . . 74.12 111.016 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.684 HD11 ' HG3' ' A' ' 27' ' ' LYS . 3.1 mp -45.27 -43.29 3.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.015 -0.539 . . . . 70.1 111.498 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -56.44 -42.33 77.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.877 -0.601 . . . . 73.33 111.092 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -85.74 -28.17 24.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.084 -0.507 . . . . 74.53 111.336 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 46' ' ' ASN . 14.2 t -77.41 -26.42 15.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 75.21 111.478 -179.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.55 -25.24 65.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.383 -0.371 . . . . 53.54 111.311 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.3 pttt -95.22 -30.95 13.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.311 -0.404 . . . . 52.31 111.136 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 m -84.98 -22.21 29.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 73.23 111.381 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -113.0 128.7 56.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.828 0.347 . . . . 62.12 111.283 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -78.9 179.89 7.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 74.04 110.447 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.623 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -60.82 -58.48 8.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.84 0.353 . . . . 70.12 110.537 179.96 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.49 -26.38 67.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.109 -0.496 . . . . 63.05 110.6 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.67 -40.4 94.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.114 0.483 . . . . 64.24 110.261 179.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.668 HD21 HG12 ' A' ' 26' ' ' ILE . 17.4 mt -77.42 -30.04 53.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.659 -0.701 . . . . 65.33 111.036 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.754 HG22 ' HB3' ' A' ' 15' ' ' LEU . 17.8 t -79.11 -43.33 24.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.942 0.401 . . . . 65.12 110.752 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 75.4 m -60.05 -34.49 73.49 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.895 -0.593 . . . . 73.44 110.486 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.684 ' HB2' ' ND1' ' A' ' 41' ' ' HIS . . . -82.01 -21.72 36.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.006 -0.543 . . . . 52.42 110.898 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.769 ' HA ' HD21 ' A' ' 29' ' ' LEU . 16.3 t80 -83.79 -22.78 31.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 72.31 110.97 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -85.07 -54.33 4.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.136 -0.483 . . . . 62.21 111.479 -179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.492 ' CE1' ' CE2' ' A' ' 37' ' ' PHE . 2.9 p-80 -62.08 -25.34 67.64 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.16 -0.473 . . . . 74.34 111.385 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.891 HD12 HD23 ' A' ' 29' ' ' LEU . 3.4 tt -53.65 -39.89 65.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.967 0.413 . . . . 74.04 110.945 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.401 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.2 m-85 -79.06 -39.88 32.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.93 -0.577 . . . . 64.42 110.641 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.1 -40.31 90.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.985 -0.552 . . . . 71.1 110.957 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 57.9 p -88.06 -9.77 52.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.033 -0.53 . . . . 74.45 111.413 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.21 33.63 12.87 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.763 0.316 . . . . 72.14 111.192 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 66.6 mtt-85 -92.52 46.18 1.23 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.356 -0.384 . . . . 65.34 111.019 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.562 ' CE1' HD22 ' A' ' 66' ' ' LEU . 91.9 m-85 -67.17 175.8 2.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 65.43 110.856 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 49.4 tttt . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.352 -0.385 . . . . 74.12 110.882 179.949 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.442 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.779 0.323 . . . . 60.11 110.959 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 30.8 p90 -149.46 162.23 40.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 75.02 110.819 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 5.8 m -132.0 103.55 6.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 75.43 111.058 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.408 ' CB ' ' HB3' ' A' ' 190' ' ' LEU . 0.8 OUTLIER -111.09 145.16 39.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.207 -0.451 . . . . 65.31 110.797 179.915 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.425 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.5 m -137.97 130.77 29.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 75.11 110.941 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 22.1 t -80.47 106.32 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 50.12 111.14 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.433 HD13 ' HA ' ' A' ' 188' ' ' ALA . 7.4 mp -76.28 -50.01 15.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.224 -0.444 . . . . 75.02 110.768 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.85 111.55 16.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.089 -0.505 . . . . 74.21 110.902 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.95 142.35 46.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 75.11 110.904 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.488 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -114.57 -155.78 11.27 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.741 -0.742 . . . . 23.4 112.615 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -37.21 -52.43 1.05 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.013 0.435 . . . . 72.5 111.415 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 71.22 35.84 1.49 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.789 -0.642 . . . . 73.2 110.178 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 57.2 m -152.98 -43.81 0.1 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.712 -0.676 . . . . 73.23 110.692 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -92.73 95.85 9.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 72.2 110.838 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -107.41 146.12 32.64 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.138 -0.483 . . . . 61.2 110.756 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -56.35 125.34 18.75 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.429 2.086 . . . . 73.32 112.454 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.02 150.37 22.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.981 -0.554 . . . . 63.32 110.909 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -53.93 114.18 1.49 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.42 . . . . 72.34 110.856 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.14 -23.62 33.87 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.58 -0.819 . . . . 53.43 112.356 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.673 ' O ' HG22 ' A' ' 166' ' ' VAL . 0.6 OUTLIER -81.58 135.59 35.56 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.817 0.341 . . . . 73.4 110.628 179.877 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.575 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 12.8 m -73.62 175.78 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.284 0.564 . . . . 44.33 111.795 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.719 HG12 HG23 ' A' ' 223' ' ' ILE . 20.5 m -157.29 146.37 10.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.247 -0.888 . . . . 71.24 110.509 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.451 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -125.43 117.29 23.35 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.983 -0.287 . . . . 72.31 110.624 179.623 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.483 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 30.9 p -153.97 167.07 30.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.951 0.405 . . . . 75.52 111.151 -179.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.629 ' HB3' HD11 ' A' ' 149' ' ' ILE . 62.2 m95 -99.67 160.73 14.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.922 -0.581 . . . . 75.44 110.074 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 34.3 p90 -158.63 134.97 9.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.102 0.477 . . . . 73.41 111.747 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.906 HG23 HG23 ' A' ' 147' ' ' THR . 0.2 OUTLIER -126.89 111.67 14.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.72 -0.673 . . . . 63.54 110.188 179.392 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.591 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.66 144.04 17.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.562 -0.828 . . . . 62.14 113.27 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.71 HG23 HG13 ' A' ' 144' ' ' VAL . 0.2 OUTLIER -150.62 142.11 23.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.806 0.336 . . . . 63.35 110.554 179.642 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.68 HD12 ' HB ' ' A' ' 143' ' ' THR . 87.7 mt -77.96 -178.21 5.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.262 -0.426 . . . . 74.5 110.93 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -58.86 -43.33 90.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.296 -0.411 . . . . 72.23 110.895 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -75.82 -4.72 42.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.96 -0.564 . . . . 55.25 111.448 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . 0.533 ' C ' HG22 ' A' ' 138' ' ' THR . . . 92.61 23.07 27.05 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.679 -0.772 . . . . 74.11 112.655 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . 0.68 ' HB ' HD12 ' A' ' 139' ' ' LEU . 1.3 m -88.28 108.31 19.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.811 0.339 . . . . 62.03 110.776 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.71 HG13 HG23 ' A' ' 138' ' ' THR . 3.7 m -71.16 132.64 33.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 60.43 111.275 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -112.19 -31.19 6.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 63.51 110.895 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -143.83 123.03 12.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 73.34 110.98 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.906 HG23 HG23 ' A' ' 136' ' ' THR . 82.9 m -137.45 105.69 5.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 61.13 110.72 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.525 ' C ' HD12 ' A' ' 149' ' ' ILE . 52.6 t30 -86.17 12.6 9.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 74.55 111.702 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.684 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.6 mp . . . . . 0 C--N 1.332 -0.186 0 CA-C-O 120.83 0.348 . . . . 71.24 110.903 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.786 0.326 . . . . 63.4 111.081 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -146.56 148.22 33.12 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 72.14 110.779 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.84 156.68 65.0 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.474 2.116 . . . . 44.02 112.233 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.2 128.02 32.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.083 -0.508 . . . . 61.04 110.746 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.61 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.6 OUTLIER -105.41 126.68 52.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.27 -0.423 . . . . 62.03 111.054 179.817 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.694 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 19.3 p90 -151.0 140.94 21.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 75.31 110.977 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.616 ' CB ' HG21 ' A' ' 168' ' ' VAL . 10.3 mtpt -69.65 131.25 44.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.333 -0.394 . . . . 64.21 110.828 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.673 HG22 ' O ' ' A' ' 129' ' ' ASP . 34.4 m -87.88 149.21 4.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 55.33 111.182 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 67.99 25.09 74.46 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.764 -0.732 . . . . 61.43 112.595 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.616 HG21 ' CB ' ' A' ' 165' ' ' LYS . 15.7 m -134.24 46.17 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.9 0.381 . . . . 75.05 111.121 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.59 35.52 3.0 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.212 -0.518 . . . . 72.43 113.276 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . 0.43 ' CG ' HG23 ' A' ' 168' ' ' VAL . 0.0 OUTLIER -82.15 -47.08 12.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.887 0.375 . . . . 72.12 111.056 -179.91 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . 0.443 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.8 OUTLIER -118.48 -179.58 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.049 -0.523 . . . . 61.03 110.971 179.829 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.539 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.22 158.39 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.453 -0.34 . . . . 72.31 111.197 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 23.5 ttm180 -66.52 -28.57 68.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.295 -0.411 . . . . 72.1 111.301 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.48 -36.53 43.72 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.659 -0.781 . . . . 63.21 112.16 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.745 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.3 t90 -78.99 -34.37 44.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.916 0.388 . . . . 64.33 111.096 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -62.46 -38.01 88.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 64.14 110.423 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . 0.551 ' O ' HG23 ' A' ' 181' ' ' THR . 2.9 mm-40 -75.45 -29.82 59.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.986 -0.552 . . . . 53.54 110.644 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.634 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -78.76 -58.32 3.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.153 -0.476 . . . . 70.35 111.128 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.694 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 5.8 mt -56.73 -34.38 67.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.983 -0.553 . . . . 51.34 110.898 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 16.4 tp -59.91 -30.34 68.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.248 -0.433 . . . . 64.25 110.694 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . 0.551 HG23 ' O ' ' A' ' 177' ' ' GLU . 32.5 p -87.11 -3.58 59.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 63.33 111.291 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 71.4 mmm -78.17 154.3 31.27 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.794 0.33 . . . . 70.23 110.718 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 10.4 p -121.19 170.33 9.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 54.42 111.175 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . 0.676 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -61.94 117.43 5.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.011 -0.541 . . . . 72.24 110.776 179.876 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . 0.407 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 70.48 66.82 2.08 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.701 -0.762 . . . . 31.44 112.224 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . 0.488 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 19.0 tt0 -146.02 147.25 31.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.636 0.255 . . . . 74.44 110.563 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . 0.429 ' HE3' ' HB2' ' A' ' 9' ' ' ALA . 2.8 ttpm? -121.98 136.54 54.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.761 0.315 . . . . 72.12 110.262 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . 0.433 ' HA ' HD13 ' A' ' 116' ' ' LEU . . . -150.0 176.16 11.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.076 0.465 . . . . 74.43 111.495 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.76 135.17 36.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.795 -0.639 . . . . 64.33 109.594 178.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.634 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.2 pt? -140.12 140.02 35.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.2 0.524 . . . . 73.4 112.361 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.682 ' HB3' HG23 ' A' ' 215' ' ' THR . 0.0 OUTLIER -116.3 112.05 20.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.54 -0.754 . . . . 61.44 109.912 178.954 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.53 HD11 ' CZ ' ' A' ' 216' ' ' PHE . 2.1 mp -97.47 143.08 13.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.001 0.429 . . . . 70.2 111.543 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -76.89 154.88 83.11 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.861 -0.609 . . . . 62.34 110.676 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . 0.452 ' CG ' ' HA ' ' A' ' 211' ' ' ASN . 73.4 Cg_exo -50.89 -39.84 58.36 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.629 2.219 . . . . 74.31 112.419 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.31 -40.63 82.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 73.42 111.235 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.442 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 5.7 m0 -96.64 36.84 1.33 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.396 -0.365 . . . . 73.51 111.147 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -162.83 -76.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 75.52 110.888 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . 0.656 ' CD2' HD11 ' A' ' 214' ' ' LEU . 25.7 m-85 -106.27 -71.21 0.76 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 73.32 110.672 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 143.05 -179.9 20.25 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.799 -0.715 . . . . 55.4 112.673 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -59.34 -33.06 70.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.846 0.355 . . . . 53.32 110.903 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -51.73 48.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 64.51 110.783 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 113.51 -138.82 15.23 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.868 -0.682 . . . . 73.43 112.474 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.649 ' CB ' HD12 ' A' ' 208' ' ' ILE . 0.4 OUTLIER -153.99 79.62 5.12 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.862 0.363 . . . . 62.41 110.824 179.99 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.9 -22.93 25.66 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.577 2.185 . . . . 63.55 112.41 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.8 -41.96 87.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.399 -0.364 . . . . 72.51 110.965 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.429 ' HB3' HG13 ' A' ' 208' ' ' ILE . . . -111.35 27.89 9.25 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.173 -0.467 . . . . 64.12 111.19 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 55.48 30.83 15.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.233 -0.44 . . . . 75.24 111.077 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.649 HD12 ' CB ' ' A' ' 203' ' ' GLN . 31.1 mt -82.14 112.66 37.57 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.431 . . . . 74.33 111.074 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -60.04 158.99 27.44 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.474 2.116 . . . . 73.01 112.303 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -55.71 145.44 71.2 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.618 2.212 . . . . 71.51 112.284 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . 0.452 ' HA ' ' CG ' ' A' ' 194' ' ' PRO . 3.2 m-80 45.0 40.93 4.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.15 -0.477 . . . . 62.11 111.358 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -83.24 112.27 19.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 73.13 111.796 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.2 mmmm -65.02 140.63 58.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.009 -0.542 . . . . 75.3 110.276 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.656 HD11 ' CD2' ' A' ' 198' ' ' TYR . 5.4 mt -117.89 109.78 16.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.949 0.405 . . . . 74.22 112.026 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.682 HG23 ' HB3' ' A' ' 191' ' ' GLU . 1.9 m -109.16 142.88 39.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.917 -0.583 . . . . 63.11 110.061 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.598 ' CE1' HD21 ' A' ' 190' ' ' LEU . 14.8 p90 -156.57 -179.27 8.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.118 0.485 . . . . 73.54 111.617 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -131.34 135.16 47.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.612 -0.722 . . . . 74.13 110.418 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.745 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.8 t -122.82 150.46 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.457 . . . . 71.52 111.915 -179.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.67 110.45 8.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.733 -0.667 . . . . 75.35 110.256 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.726 HD21 HG13 ' A' ' 223' ' ' ILE . 2.0 tt -69.84 128.55 36.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.39 -0.368 . . . . 54.01 111.02 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 24.6 t -108.51 -29.07 2.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.158 -0.474 . . . . 62.45 111.296 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . 0.407 ' N ' HD23 ' A' ' 220' ' ' LEU . 5.4 t70 -170.41 161.14 7.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.881 0.372 . . . . 72.13 111.006 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.726 HG13 HD21 ' A' ' 220' ' ' LEU . 41.7 mt -140.19 110.62 3.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.096 -0.502 . . . . 71.12 111.057 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . 0.524 ' HB2' HG23 ' A' ' 130' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 74.03 110.859 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 1.041 HG11 HG21 ' A' ' 136' ' ' THR . 50.3 t . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.637 0.256 . . . . 63.45 111.157 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -81.59 138.84 10.97 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.738 2.292 . . . . 71.54 112.325 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.436 HE22 HD11 ' A' ' 149' ' ' ILE . 11.5 mm100 -81.14 148.84 29.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 70.42 111.052 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.565 ' NE ' HD13 ' A' ' 149' ' ' ILE . 0.0 OUTLIER -51.92 120.59 5.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 74.25 111.102 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -94.95 -10.96 29.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.065 -0.516 . . . . 72.34 111.403 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.612 ' CD1' HD11 ' A' ' 20' ' ' LEU . 3.8 m-90 -138.19 173.67 11.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.912 0.386 . . . . 74.1 110.863 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.433 ' O ' HD12 ' A' ' 15' ' ' LEU . 1.3 m -118.22 152.06 36.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.009 -0.541 . . . . 75.02 110.661 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.506 HG12 ' HD2' ' A' ' 16' ' ' ARG . 34.2 t -57.71 -33.34 44.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.369 -0.378 . . . . 74.41 110.685 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -77.37 -24.94 50.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.964 -0.562 . . . . 62.5 111.037 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.03 -57.65 3.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.832 0.348 . . . . 70.25 110.843 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.709 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.4 mt -51.1 -60.71 2.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.221 -0.445 . . . . 72.24 111.001 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.619 ' HG3' HG11 ' A' ' 60' ' ' VAL . 28.1 mtt180 -54.16 -24.14 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 75.24 111.114 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.12 177.86 0.31 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.307 -0.406 . . . . 70.15 111.045 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -110.31 16.72 21.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.935 -0.575 . . . . 72.21 111.167 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -104.39 -27.86 11.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.514 -0.312 . . . . 73.24 111.156 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.834 HD22 HD11 ' A' ' 25' ' ' ILE . 6.5 tt -86.84 132.16 42.97 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.394 -0.366 . . . . 75.31 111.015 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.636 ' N ' HD23 ' A' ' 20' ' ' LEU . 71.1 Cg_endo -74.48 124.97 9.28 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.52 2.147 . . . . 74.44 112.398 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.402 ' HB3' ' NZ ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -56.93 -26.33 59.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 74.42 111.188 -179.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 mmtp -54.65 -49.06 71.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.301 -0.409 . . . . 62.52 111.293 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.05 -33.17 74.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.127 -0.488 . . . . 72.13 111.19 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.834 HD11 HD22 ' A' ' 20' ' ' LEU . 30.1 mt -66.9 -36.53 77.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 62.23 111.223 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.692 HG12 HD21 ' A' ' 59' ' ' LEU . 15.8 mt -71.85 -50.16 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.229 -0.442 . . . . 62.02 111.105 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.509 ' HG3' HD11 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -57.35 -22.9 45.53 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.847 -0.615 . . . . 45.21 111.286 -179.856 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -74.46 -50.81 16.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.013 0.435 . . . . 71.44 110.809 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.75 HD21 ' HA ' ' A' ' 63' ' ' TYR . 4.5 mt -64.3 -39.17 93.37 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.87 -0.605 . . . . 73.24 110.957 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -71.18 -20.22 62.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.309 -0.405 . . . . 73.22 110.727 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.444 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 9.4 tp10 -79.58 -52.21 8.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.133 -0.485 . . . . 64.54 111.472 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.444 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 84.4 m-70 -111.18 16.48 21.0 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.876 0.325 . . . . 73.23 111.876 -179.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' A' ' 29' ' ' LEU . . . -123.05 91.08 0.44 Allowed Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.517 -0.849 . . . . 71.05 112.631 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.1 p -33.68 156.08 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.672 0.619 . . . . 55.21 112.672 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.467 ' HA ' HD12 ' A' ' 38' ' ' LEU . 1.8 p-10 -51.45 -55.91 16.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.673 -0.694 . . . . 63.35 111.443 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.2 t -47.83 -48.05 31.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.04 0.447 . . . . 53.34 110.702 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.493 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 15.9 t80 -55.05 -49.0 72.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.678 -0.692 . . . . 75.5 110.727 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.748 HD22 ' HB3' ' A' ' 43' ' ' LEU . 11.6 mt -62.54 -45.54 92.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 64.14 110.937 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.947 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -49.93 -31.89 13.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.295 -0.411 . . . . 62.31 111.309 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -71.35 -33.15 69.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 74.11 111.034 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.534 ' ND1' ' HB2' ' A' ' 62' ' ' ALA . 14.3 m-70 -110.03 13.32 23.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.348 -0.387 . . . . 75.02 111.502 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt 58.86 33.67 23.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.794 0.331 . . . . 65.1 111.004 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.748 ' HB3' HD22 ' A' ' 38' ' ' LEU . 17.8 mt -88.76 -20.1 25.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.28 -0.418 . . . . 73.03 111.107 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.947 HD11 ' HB2' ' A' ' 39' ' ' ALA . 84.1 mt -47.77 170.32 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.894 0.378 . . . . 51.15 111.175 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.45 -154.78 24.45 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.771 -0.728 . . . . 64.41 112.778 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.87 ' O ' HG23 ' A' ' 50' ' ' VAL . 40.5 m-20 -109.92 150.4 28.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.96 0.41 . . . . 72.44 111.078 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.509 HD11 ' HG3' ' A' ' 27' ' ' LYS . 3.2 mp -46.71 -39.6 4.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.972 -0.558 . . . . 75.24 111.434 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -60.21 -42.45 95.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.057 -0.52 . . . . 64.43 111.102 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -85.56 -26.62 26.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.077 -0.51 . . . . 52.43 111.216 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.87 HG23 ' O ' ' A' ' 46' ' ' ASN . 17.5 t -79.58 -25.83 12.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.405 . . . . 73.53 111.448 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.42 -27.74 68.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.388 -0.369 . . . . 52.5 111.127 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.9 ptpp? -95.18 -29.21 14.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 65.15 110.986 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -96.34 33.55 1.76 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.449 . . . . 63.12 111.13 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -163.68 125.79 2.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.366 -0.379 . . . . 75.42 111.123 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.22 174.64 11.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 73.44 110.633 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.593 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -57.68 -58.29 8.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.892 0.377 . . . . 73.14 110.521 179.945 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.56 -24.48 67.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.005 -0.543 . . . . 72.33 110.584 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.21 -42.57 99.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.15 -0.477 . . . . 64.22 110.375 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.692 HD21 HG12 ' A' ' 26' ' ' ILE . 15.3 mt -74.85 -29.99 61.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.714 -0.675 . . . . 75.32 111.059 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.709 HG22 ' HB3' ' A' ' 15' ' ' LEU . 12.4 t -80.4 -43.87 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.987 0.422 . . . . 73.11 110.824 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.7 m -58.86 -34.33 71.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.93 -0.577 . . . . 73.41 110.532 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.534 ' HB2' ' ND1' ' A' ' 41' ' ' HIS . . . -83.59 -21.77 32.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.997 -0.547 . . . . 62.21 110.952 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.75 ' HA ' HD21 ' A' ' 29' ' ' LEU . 26.8 t80 -82.29 -22.88 35.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 70.42 111.025 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.568 ' ND2' HG12 ' A' ' 60' ' ' VAL . 48.3 m-80 -85.82 -53.18 5.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 74.2 111.474 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.493 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.2 p-80 -62.76 -27.5 69.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.991 -0.549 . . . . 73.31 111.498 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.711 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.5 tt -50.67 -40.68 54.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.871 0.367 . . . . 62.45 111.091 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -79.05 -40.84 30.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.015 -0.539 . . . . 72.4 110.682 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.82 -38.58 91.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.978 -0.556 . . . . 73.41 111.012 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.9 p -87.35 -11.84 48.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.091 -0.504 . . . . 61.55 111.46 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.724 ' HD3' HG21 ' A' ' 144' ' ' VAL . 25.0 mtmt 55.07 32.26 17.9 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.737 0.303 . . . . 75.13 111.161 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 30.9 mtt-85 -91.53 47.22 1.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.32 -0.4 . . . . 71.05 111.023 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -68.28 171.84 6.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 71.53 110.855 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.5 tttp . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.28 -0.418 . . . . 74.42 110.928 179.942 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.461 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.742 0.306 . . . . 75.0 111.123 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.448 ' CZ ' ' HB2' ' A' ' 177' ' ' GLU . 4.1 p90 -132.73 -176.56 4.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 73.52 110.622 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.48 105.59 1.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.796 0.332 . . . . 75.33 111.06 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.483 ' CG ' HD22 ' A' ' 190' ' ' LEU . 0.0 OUTLIER -101.66 139.92 36.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 75.22 110.808 179.837 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.436 ' O ' ' HB1' ' A' ' 188' ' ' ALA . 0.4 OUTLIER -132.34 122.72 25.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 63.23 110.905 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.608 ' O ' HG13 ' A' ' 115' ' ' VAL . 9.5 p -84.0 106.38 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.472 . . . . 54.04 111.067 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.575 HD22 ' N ' ' A' ' 116' ' ' LEU . 2.8 mm? -87.68 -43.33 12.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 73.02 110.788 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 11.8 ttpp -118.22 107.9 14.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 73.23 110.94 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.08 134.36 55.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.211 -0.45 . . . . 74.14 111.057 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -103.23 -106.03 3.02 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.716 -0.754 . . . . 71.32 112.329 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.79 -42.78 11.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.96 0.41 . . . . 71.03 110.703 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.09 33.9 3.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.952 -0.567 . . . . 74.13 110.836 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 61.2 m -156.32 -45.6 0.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 71.23 110.839 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 -83.22 91.88 7.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 63.03 110.972 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -103.71 141.79 23.24 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 71.03 110.821 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.69 125.55 19.44 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.493 2.128 . . . . 72.22 112.356 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -97.98 158.88 15.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.117 -0.492 . . . . 64.03 110.849 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.91 111.13 1.18 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.275 -0.42 . . . . 71.4 110.809 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 111.33 -36.66 4.09 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.755 -0.736 . . . . 61.14 112.338 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.606 ' O ' HG22 ' A' ' 166' ' ' VAL . 0.5 OUTLIER -71.1 130.93 42.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 63.12 110.677 179.854 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.536 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 5.9 m -73.86 179.71 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.98 0.419 . . . . 70.2 111.429 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.804 HG12 HG23 ' A' ' 223' ' ' ILE . 21.5 m -156.84 147.69 11.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.8 -0.636 . . . . 74.34 110.916 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.427 ' HB3' ' HB2' ' A' ' 161' ' ' PRO . 0.7 OUTLIER -124.94 117.7 24.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.553 -0.294 . . . . 63.1 110.38 179.496 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.5 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.1 p -153.73 166.88 31.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.999 0.428 . . . . 55.43 111.509 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.624 ' O ' HG13 ' A' ' 218' ' ' VAL . 54.9 m95 -100.44 163.73 12.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.796 -0.638 . . . . 73.21 110.159 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.453 ' CD1' ' HB2' ' A' ' 148' ' ' ASN . 27.9 p90 -159.2 135.19 8.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.888 0.375 . . . . 64.23 111.593 -179.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 1.041 HG21 HG11 ' A' ' 5' ' ' VAL . 3.4 m -122.47 106.39 10.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.088 -0.505 . . . . 63.41 110.941 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.738 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -85.98 135.79 13.67 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.938 -0.649 . . . . 70.12 113.32 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.868 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -147.43 143.19 27.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.802 0.334 . . . . 73.53 110.617 179.599 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 139' ' ' LEU . 32.3 mt -81.95 -177.47 6.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 64.44 110.871 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -56.76 -42.86 80.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.469 . . . . 44.11 110.902 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.61 -9.07 58.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.949 -0.569 . . . . 72.3 111.31 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 93.33 25.86 17.63 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.64 -0.79 . . . . 72.12 112.569 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 30.4 m -87.32 108.59 19.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.808 0.337 . . . . 61.1 110.87 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.724 HG21 ' HD3' ' A' ' 70' ' ' LYS . 21.2 t -63.72 127.46 24.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 51.54 111.089 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.428 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 52.1 p90 -110.13 -31.09 7.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.272 -0.422 . . . . 72.2 110.919 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -167.88 112.19 0.66 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 74.52 110.87 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.65 ' OG1' HG23 ' A' ' 136' ' ' THR . 11.9 t -125.07 126.9 46.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.211 -0.45 . . . . 53.01 110.965 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.453 ' HB2' ' CD1' ' A' ' 135' ' ' TYR . 8.8 t30 -65.58 -21.81 66.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.126 -0.488 . . . . 74.33 111.159 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.565 HD13 ' NE ' ' A' ' 8' ' ' ARG . 21.4 mt . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.393 -0.367 . . . . 61.23 111.417 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.465 ' HB1' ' CH2' ' A' ' 134' ' ' TRP . . . . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.814 0.34 . . . . 52.34 111.052 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 7.4 mtpt -131.13 119.36 17.74 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 72.1 110.881 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . 0.427 ' HB2' ' HB3' ' A' ' 132' ' ' HIS . 54.0 Cg_exo -52.44 151.16 18.83 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.418 2.079 . . . . 74.14 112.26 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 2.5 tt -79.12 127.78 32.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 74.24 110.706 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.607 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 1.1 p -109.02 127.42 54.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.919 0.39 . . . . 63.14 111.346 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.772 ' CZ ' HD12 ' A' ' 179' ' ' LEU . 15.6 p90 -153.13 145.27 23.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.965 -0.562 . . . . 75.45 110.713 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.643 ' O ' HG22 ' A' ' 168' ' ' VAL . 15.8 mtmt -71.8 134.34 46.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.959 0.409 . . . . 74.31 111.028 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.606 HG22 ' O ' ' A' ' 129' ' ' ASP . 27.0 m -87.93 149.17 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.94 -0.573 . . . . 74.34 111.345 -179.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 62.43 29.24 72.78 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.827 -0.701 . . . . 73.51 112.607 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.643 HG22 ' O ' ' A' ' 165' ' ' LYS . 35.4 m -116.76 -33.01 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.927 0.394 . . . . 63.3 111.578 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 111.99 31.29 2.72 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.69 -0.767 . . . . 61.23 111.443 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -88.59 -29.71 19.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.759 0.314 . . . . 70.41 111.067 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 14.8 m -121.75 179.63 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 75.25 111.245 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.502 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 2.7 pt -59.58 169.45 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.108 -0.496 . . . . 63.22 111.082 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -76.05 -28.41 57.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.315 -0.402 . . . . 72.0 111.099 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -73.15 -30.57 62.76 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.72 -0.752 . . . . 74.55 112.015 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.794 ' HE1' HG21 ' A' ' 218' ' ' VAL . 0.6 OUTLIER -84.05 -34.46 24.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.88 0.372 . . . . 74.12 110.838 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -58.31 -40.76 82.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.036 -0.529 . . . . 73.11 110.488 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . 0.448 ' HB2' ' CZ ' ' A' ' 111' ' ' TYR . 4.8 mt-10 -80.14 -29.4 38.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.847 -0.615 . . . . 74.41 110.631 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.483 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -76.07 -60.77 2.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.205 -0.452 . . . . 64.31 111.23 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.772 HD12 ' CZ ' ' A' ' 164' ' ' PHE . 0.3 OUTLIER -56.3 -35.04 67.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.975 -0.557 . . . . 73.32 110.992 -179.95 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.5 tp -64.76 -28.4 69.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 63.43 111.06 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 22.4 m -89.5 -8.81 52.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.3 -0.409 . . . . 63.53 111.444 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -77.6 156.29 30.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.819 0.342 . . . . 75.31 110.963 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.81 168.96 9.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 73.23 110.875 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . 0.605 ' HA ' HD11 ' A' ' 223' ' ' ILE . 16.6 tttp -68.36 125.31 26.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.272 -0.422 . . . . 71.54 110.99 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 70.28 35.34 69.71 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.834 -0.698 . . . . 72.24 112.597 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -120.37 147.24 45.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.831 0.348 . . . . 75.22 110.922 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt -114.82 140.49 48.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 72.1 110.117 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . 0.436 ' HB1' ' O ' ' A' ' 114' ' ' SER . . . -147.58 175.86 10.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.028 0.442 . . . . 75.04 111.705 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . 0.469 ' C ' HD23 ' A' ' 190' ' ' LEU . 0.0 OUTLIER -128.23 120.05 26.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.777 -0.647 . . . . 72.13 109.981 179.568 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.857 ' O ' HG23 ' A' ' 215' ' ' THR . 3.5 mt -99.4 161.66 13.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.429 0.633 . . . . 71.42 112.271 -179.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -149.13 105.11 3.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.843 -1.071 . . . . 63.14 109.696 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.547 HG21 ' O ' ' A' ' 196' ' ' TRP . 3.0 mt -111.7 138.12 41.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.065 0.459 . . . . 75.45 111.798 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.423 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.3 mt-10 -75.84 167.83 33.22 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.647 -0.706 . . . . 54.44 110.445 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . 0.423 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 36.3 Cg_endo -64.8 -15.56 50.91 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.46 2.107 . . . . 74.33 112.633 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.14 -24.78 30.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.567 -0.288 . . . . 72.34 111.701 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.547 ' O ' HG21 ' A' ' 192' ' ' ILE . 3.0 m0 -110.37 37.18 2.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.74 0.305 . . . . 74.41 111.558 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . 0.487 ' HB1' HD12 ' A' ' 214' ' ' LEU . . . -149.78 -83.07 0.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.428 -0.351 . . . . 72.34 111.43 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . 0.647 ' CE2' HD13 ' A' ' 208' ' ' ILE . 25.5 m-85 -107.72 -31.65 7.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.98 0.419 . . . . 73.02 110.921 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 119.61 169.18 14.13 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.875 -0.679 . . . . 61.4 112.629 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.01 -29.75 44.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.885 0.374 . . . . 73.22 110.834 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -67.34 -46.88 72.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.081 -0.509 . . . . 73.52 110.68 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.56 -141.81 16.74 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.819 -0.705 . . . . 74.33 112.396 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.647 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.0 OUTLIER -155.77 79.41 4.25 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 120.846 0.355 . . . . 64.42 110.773 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.16 -22.68 26.53 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.65 2.233 . . . . 74.13 112.567 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.01 -42.05 84.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.898 0.38 . . . . 62.22 110.992 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.73 31.2 6.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.116 -0.493 . . . . 70.03 111.11 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 18.1 mtpt 56.86 32.95 22.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.246 -0.434 . . . . 75.55 110.935 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.647 HD12 ' HB3' ' A' ' 203' ' ' GLN . 50.4 mt -93.26 111.8 53.55 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.143 -0.481 . . . . 74.22 111.046 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -69.16 170.67 15.32 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.426 2.084 . . . . 61.02 112.384 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.23 151.47 49.04 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.63 2.22 . . . . 73.4 112.461 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . 0.401 ' HA ' ' CG ' ' A' ' 194' ' ' PRO . 24.2 m-80 57.15 24.86 10.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 71.11 111.329 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -83.75 147.22 27.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.894 0.378 . . . . 74.43 111.467 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . 0.728 ' O ' HD23 ' A' ' 214' ' ' LEU . 1.0 OUTLIER -93.92 156.09 16.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 72.14 110.303 179.519 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.728 HD23 ' O ' ' A' ' 213' ' ' LYS . 14.1 mt -136.4 109.51 7.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.953 0.406 . . . . 52.13 111.857 -179.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.857 HG23 ' O ' ' A' ' 190' ' ' LEU . 94.9 m -111.27 141.19 45.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.933 -0.576 . . . . 74.53 110.251 179.504 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.738 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 21.4 p90 -161.78 120.12 2.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.951 0.405 . . . . 74.52 111.73 -179.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.68 139.45 47.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.022 -0.535 . . . . 75.32 110.813 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.794 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.6 t -123.02 151.32 27.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.997 -0.547 . . . . 60.31 111.102 -179.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -136.8 111.32 8.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.281 -0.418 . . . . 64.24 110.639 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.735 HD13 HD11 ' A' ' 223' ' ' ILE . 0.4 OUTLIER -69.56 129.54 39.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.842 0.353 . . . . 71.13 110.835 -179.722 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 40.1 t -107.37 -30.54 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.475 . . . . 74.44 111.07 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -167.74 157.8 10.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.211 -0.45 . . . . 62.24 110.895 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.804 HG23 HG12 ' A' ' 131' ' ' VAL . 3.9 mp -141.14 111.31 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 74.11 111.091 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 34.5 t70 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 62.21 110.935 -179.961 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.702 HG23 ' OG1' ' A' ' 138' ' ' THR . 42.4 t . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 120.602 0.239 . . . . 72.22 110.798 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.454 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.3 Cg_endo -78.48 134.67 12.64 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.654 2.236 . . . . 74.21 112.525 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -80.19 156.54 26.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.178 -0.464 . . . . 61.13 110.807 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.25 93.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 60.24 111.379 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.44 86.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 73.33 110.992 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.573 ' CD1' HD11 ' A' ' 20' ' ' LEU . 1.5 m-90 -115.46 173.64 6.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.966 -0.561 . . . . 73.53 110.689 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.482 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -118.2 154.77 31.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.101 -0.5 . . . . 73.51 110.618 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.421 HG13 ' CD ' ' A' ' 16' ' ' ARG . 95.9 t -57.11 -35.87 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.973 0.416 . . . . 64.31 110.501 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -67.96 -30.34 69.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.87 -0.605 . . . . 41.44 111.143 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -82.04 -56.09 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.37 -0.377 . . . . 74.32 111.238 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.755 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.5 mt -49.55 -65.6 0.54 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.285 -0.416 . . . . 75.3 111.327 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.899 ' HD2' HG11 ' A' ' 60' ' ' VAL . 0.1 OUTLIER -53.71 -25.49 18.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 65.21 111.259 -179.898 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.42 173.68 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.99 0.424 . . . . 75.52 111.36 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.38 17.04 21.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.888 -0.596 . . . . 72.41 111.176 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -112.23 -19.98 12.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.655 0.264 . . . . 73.42 111.307 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.573 HD11 ' CD1' ' A' ' 10' ' ' TRP . 2.1 tt -90.59 112.18 51.68 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.609 -0.269 . . . . 74.54 111.008 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -57.69 128.42 29.1 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.411 2.074 . . . . 72.42 112.227 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.834 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -63.4 -24.15 67.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.462 . . . . 74.24 111.204 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.458 ' HA ' HD12 ' A' ' 26' ' ' ILE . 3.6 tptt -51.76 -40.13 59.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.394 -0.366 . . . . 74.5 111.581 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.89 -57.42 4.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.957 0.408 . . . . 70.43 111.164 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.834 HD12 ' HA ' ' A' ' 22' ' ' LYS . 4.7 mt -44.81 -32.78 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.891 -0.595 . . . . 75.44 111.556 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.673 HG12 HD21 ' A' ' 59' ' ' LEU . 7.4 mt -75.1 -40.7 44.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.937 0.399 . . . . 74.11 110.991 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -71.02 -24.03 62.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.977 -0.556 . . . . 63.33 111.029 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 24.1 t80 -71.47 -45.05 63.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.041 0.448 . . . . 53.41 110.86 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.854 HD13 HD13 ' A' ' 43' ' ' LEU . 6.1 mt -69.57 -24.01 63.64 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.783 -0.644 . . . . 74.52 111.11 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -79.3 -25.05 42.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.348 -0.387 . . . . 74.4 111.005 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.1 -10.58 18.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.384 -0.371 . . . . 72.33 111.24 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 11.9 m170 -117.62 -9.7 10.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.54 -0.3 . . . . 75.52 111.438 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.49 164.4 15.53 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.688 -0.768 . . . . 64.21 112.379 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.98 150.4 21.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.683 0.277 . . . . 61.51 110.555 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.681 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.5 OUTLIER -48.55 -57.01 6.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.833 0.349 . . . . 45.54 111.02 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.92 -49.57 39.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.054 0.454 . . . . 51.22 110.625 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.55 ' CE2' HD12 ' A' ' 66' ' ' LEU . 14.8 t80 -54.61 -48.02 72.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.707 -0.678 . . . . 63.24 110.431 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.419 HD21 ' O ' ' A' ' 29' ' ' LEU . 14.6 mt -63.98 -42.02 97.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.933 -0.576 . . . . 75.32 110.837 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.824 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -46.68 -40.29 12.96 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.187 -0.46 . . . . 71.12 111.05 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.432 ' HB3' ' CD2' ' A' ' 41' ' ' HIS . 0.6 OUTLIER -48.56 -50.13 33.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.806 -0.634 . . . . 73.24 111.09 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.432 ' CD2' ' HB3' ' A' ' 40' ' ' GLU . 5.3 m-70 -102.46 14.04 32.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.088 -0.505 . . . . 74.25 111.293 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.2 mttt 57.47 42.0 25.21 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.842 0.353 . . . . 74.55 110.959 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.854 HD13 HD13 ' A' ' 29' ' ' LEU . 19.8 mt -92.25 -22.43 19.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 71.14 111.463 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.824 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -77.6 156.8 30.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.026 0.441 . . . . 72.14 111.23 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.31 -122.27 5.39 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.646 -0.707 . . . . 73.33 112.489 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.846 ' O ' HG23 ' A' ' 50' ' ' VAL . 4.8 m120 -116.3 117.76 30.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.814 0.34 . . . . 74.44 110.964 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.665 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.97 -54.96 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.186 -0.461 . . . . 73.24 111.414 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.2 -37.81 16.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.9 -0.591 . . . . 45.33 111.075 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -85.77 -25.58 26.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.009 -0.541 . . . . 70.33 111.13 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.846 HG23 ' O ' ' A' ' 46' ' ' ASN . 25.1 t -82.35 -25.82 8.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 75.41 111.423 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.21 -15.78 63.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.815 0.341 . . . . 71.14 111.189 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.12 -32.36 13.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 75.55 110.914 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.0 m -88.82 -33.6 17.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.326 -0.397 . . . . 73.53 111.053 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -91.96 125.34 36.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 71.03 111.191 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -82.09 175.83 10.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 73.11 110.602 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.532 ' O ' HG23 ' A' ' 60' ' ' VAL . 6.9 tptt -58.42 -58.18 9.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.857 0.36 . . . . 73.54 110.587 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.0 -26.67 68.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.083 -0.508 . . . . 65.4 110.503 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -42.85 99.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.128 -0.487 . . . . 72.21 110.376 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.673 HD21 HG12 ' A' ' 26' ' ' ILE . 19.3 mt -71.6 -32.75 68.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.69 -0.686 . . . . 74.31 110.928 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.899 HG11 ' HD2' ' A' ' 16' ' ' ARG . 13.0 t -78.43 -42.29 26.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 52.24 110.94 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.3 m -59.41 -36.94 76.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.964 -0.562 . . . . 74.35 110.64 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.465 ' HB3' HD11 ' A' ' 43' ' ' LEU . . . -80.75 -22.17 40.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.019 -0.537 . . . . 75.11 110.999 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.647 ' HA ' HD21 ' A' ' 29' ' ' LEU . 21.6 t80 -83.78 -22.85 31.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 71.42 111.026 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.475 ' ND2' HG12 ' A' ' 60' ' ' VAL . 16.8 m-80 -83.09 -54.73 4.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.279 -0.419 . . . . 74.35 111.545 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.501 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 4.2 p-80 -61.7 -29.13 69.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.098 -0.501 . . . . 71.0 111.366 -179.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.603 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.0 tt -51.98 -39.27 59.09 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.901 0.381 . . . . 74.24 111.118 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -78.81 -36.53 42.54 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.068 -0.514 . . . . 70.52 110.608 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.97 -39.87 83.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.961 -0.563 . . . . 61.53 110.745 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.68 -3.52 52.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.978 -0.556 . . . . 72.02 111.359 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.641 ' HE2' HG21 ' A' ' 136' ' ' THR . 8.3 mmtp 48.5 38.97 11.99 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.752 0.31 . . . . 75.41 111.316 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -93.85 43.5 1.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.379 . . . . 64.05 111.111 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.552 ' HA ' HD21 ' A' ' 66' ' ' LEU . 86.4 m-85 -66.3 179.61 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.434 . . . . 74.34 110.889 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.9 tttt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 72.41 110.893 179.908 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.87 0.366 . . . . 74.43 110.819 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -165.66 163.95 19.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 70.12 110.807 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . 0.413 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 33.3 m -128.33 129.0 45.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.469 . . . . 75.4 110.668 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.708 ' HD2' ' HB1' ' A' ' 178' ' ' ALA . 8.0 tttm -128.88 151.47 49.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.31 -0.405 . . . . 61.53 110.972 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.407 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.4 m -150.27 123.14 8.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 60.24 110.872 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 29.8 t -80.37 106.33 11.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 73.24 111.454 -179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.407 HD12 ' O ' ' A' ' 114' ' ' SER . 7.5 mp -76.46 -59.99 2.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.143 -0.48 . . . . 63.34 110.497 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -112.94 108.05 16.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.93 -0.577 . . . . 62.01 110.681 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.8 mtmp? -60.97 142.86 56.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 70.43 110.969 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.404 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -110.44 -159.04 16.72 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.773 -0.727 . . . . 65.32 112.211 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -35.03 -46.71 0.33 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.814 0.34 . . . . 63.1 111.654 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.626 ' O ' HG23 ' A' ' 122' ' ' THR . 0.5 OUTLIER 72.6 39.21 0.72 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 73.41 110.3 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.626 HG23 ' O ' ' A' ' 121' ' ' LYS . 0.8 OUTLIER -167.71 -42.68 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.686 -0.688 . . . . 71.41 110.423 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -84.71 86.4 7.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.018 -0.537 . . . . 75.13 110.669 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -106.0 155.54 38.23 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.044 -0.525 . . . . 64.34 110.822 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.6 ' HB2' HG21 ' A' ' 166' ' ' VAL . 56.0 Cg_endo -70.25 125.53 11.99 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.537 2.158 . . . . 50.54 112.469 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.25 155.66 17.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.095 -0.502 . . . . 74.25 110.867 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 1.1 tptm -56.92 119.23 5.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 75.51 110.945 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 94.44 -9.41 71.73 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.721 -0.752 . . . . 74.01 112.758 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.27 140.15 29.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.871 0.367 . . . . 62.53 110.995 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.69 HG12 ' O ' ' A' ' 224' ' ' ASP . 7.3 p -70.86 162.44 4.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.107 -0.497 . . . . 70.03 111.014 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.743 HG22 ' O ' ' A' ' 164' ' ' PHE . 4.4 m -153.59 144.98 14.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.137 -0.483 . . . . 64.54 111.009 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.451 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.87 117.84 22.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.738 0.304 . . . . 73.41 110.763 179.528 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.735 ' HB3' HD22 ' A' ' 220' ' ' LEU . 30.3 p -150.21 168.94 22.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.077 0.465 . . . . 54.44 111.102 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.838 ' HB3' HD11 ' A' ' 149' ' ' ILE . 80.6 m95 -102.64 157.52 16.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.729 -0.669 . . . . 64.14 110.015 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 53.2 p90 -162.23 138.73 7.86 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.148 0.499 . . . . 72.43 112.055 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.679 HG21 HG11 ' A' ' 5' ' ' VAL . 22.1 m -131.35 116.23 17.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.478 -0.783 . . . . 73.24 110.335 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.599 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -98.16 145.17 17.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.601 -0.809 . . . . 63.12 113.291 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.702 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.1 OUTLIER -147.9 143.24 27.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.832 0.349 . . . . 62.34 110.75 179.756 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.778 HD11 HG12 ' A' ' 208' ' ' ILE . 90.7 mt -88.64 -179.53 6.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 73.33 110.756 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -52.88 -45.14 67.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.301 -0.409 . . . . 74.01 111.075 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.0 -13.22 62.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.974 -0.557 . . . . 74.01 111.326 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 88.27 25.85 29.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.651 -0.785 . . . . 64.45 112.59 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -98.27 124.88 43.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.815 0.341 . . . . 74.21 110.817 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.2 t -63.7 129.41 27.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 62.23 111.085 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.43 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 54.1 p90 -110.83 -33.65 6.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 73.24 111.012 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . 0.41 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 13.9 m-20 -162.53 110.27 1.32 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 75.42 110.949 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 9.2 t -142.91 127.68 18.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 71.44 110.951 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 34.2 p-10 -92.71 52.58 1.89 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 73.23 110.385 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.838 HD11 ' HB3' ' A' ' 134' ' ' TRP . 27.9 mm . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.064 -0.516 . . . . 65.53 110.886 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.817 0.341 . . . . 73.12 111.08 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.25 146.45 36.47 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 65.03 110.819 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.42 155.84 68.66 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.538 2.159 . . . . 72.33 112.234 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.417 ' O ' HD23 ' A' ' 162' ' ' LEU . 3.6 tt -75.44 121.44 22.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.31 -0.404 . . . . 73.32 110.576 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.621 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.67 122.29 42.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.946 0.403 . . . . 73.13 111.305 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.743 ' O ' HG22 ' A' ' 131' ' ' VAL . 10.8 p90 -151.81 143.67 23.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.909 -0.587 . . . . 72.34 110.557 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.581 ' O ' HG22 ' A' ' 168' ' ' VAL . 4.6 mttp -80.96 138.71 36.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.079 0.466 . . . . 73.24 111.323 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.6 HG21 ' HB2' ' A' ' 125' ' ' PRO . 35.8 m -87.38 149.42 4.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.618 -0.719 . . . . 71.52 111.188 -179.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.77 21.71 78.86 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.805 -0.712 . . . . 53.23 112.637 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.745 HG23 ' HG2' ' A' ' 170' ' ' LYS . 29.3 m -130.16 41.15 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.871 0.367 . . . . 74.13 111.134 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.47 38.58 5.34 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 121.125 -0.56 . . . . 74.23 113.154 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . 0.745 ' HG2' HG23 ' A' ' 168' ' ' VAL . 0.4 OUTLIER -84.69 -41.86 15.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.865 0.364 . . . . 72.35 110.95 -179.945 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.7 m -121.95 179.78 2.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.112 -0.494 . . . . 54.24 110.994 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.539 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -59.88 159.48 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.331 -0.395 . . . . 75.44 111.158 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -67.72 -28.26 67.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.204 -0.453 . . . . 72.03 111.139 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.5 -37.58 46.43 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.668 -0.777 . . . . 61.32 111.958 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.714 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.3 t90 -78.33 -33.48 49.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.919 0.39 . . . . 62.43 110.998 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . 0.697 ' O ' HD13 ' A' ' 180' ' ' LEU . 38.9 t70 -64.31 -33.87 76.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.967 -0.561 . . . . 75.33 110.444 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -78.65 -29.71 45.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 71.4 110.662 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.708 ' HB1' ' HD2' ' A' ' 113' ' ' LYS . . . -81.16 -45.47 16.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 50.21 111.105 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.62 HD21 ' NE1' ' A' ' 175' ' ' TRP . 11.8 mt -72.39 -18.92 61.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.016 -0.538 . . . . 74.25 111.167 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.697 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.3 tp -56.38 -24.18 42.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.429 -0.351 . . . . 72.54 111.345 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 16.2 p -114.5 18.09 16.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.627 -0.26 . . . . 75.3 111.618 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 3.5 mmm -68.13 103.48 1.56 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.869 0.366 . . . . 73.02 110.913 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.22 148.99 49.06 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.195 -0.457 . . . . 75.13 110.839 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 3.2 ttmt -54.85 115.77 2.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.506 . . . . 70.31 111.216 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 77.39 20.05 75.48 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.921 -0.656 . . . . 60.02 113.201 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . 0.404 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.6 tt0 -93.69 146.48 23.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.867 0.333 . . . . 73.3 111.032 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -119.22 136.23 54.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 73.24 109.936 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -150.57 176.25 11.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.106 0.479 . . . . 63.34 111.831 -179.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.88 133.52 33.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.604 -0.726 . . . . 73.22 109.477 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.701 HD11 ' CD1' ' A' ' 175' ' ' TRP . 1.6 pt? -140.07 141.53 36.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.135 0.493 . . . . 74.45 112.109 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.828 ' HG3' HG23 ' A' ' 215' ' ' THR . 2.5 mp0 -116.94 112.39 20.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.549 -0.75 . . . . 64.22 110.021 179.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.58 HD11 HD12 ' A' ' 190' ' ' LEU . 1.3 mm -92.18 150.26 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.922 0.391 . . . . 73.35 111.214 -179.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -83.37 166.4 35.04 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.525 . . . . 72.53 110.69 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . 0.402 ' CB ' ' HA ' ' A' ' 211' ' ' ASN . 40.1 Cg_endo -66.91 -14.76 44.95 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.532 2.155 . . . . 73.1 112.6 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -84.23 -31.18 25.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 62.13 111.034 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.435 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 14.4 m0 -107.54 37.03 2.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.416 . . . . 74.02 111.075 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -154.44 -81.06 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 64.41 111.087 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . 0.582 ' CE2' HD11 ' A' ' 214' ' ' LEU . 41.7 m-85 -106.11 -71.31 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.033 0.444 . . . . 74.13 110.762 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 151.34 176.56 24.28 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.721 -0.752 . . . . 43.32 112.597 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.31 -30.01 36.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.857 0.36 . . . . 74.42 110.798 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -49.73 19.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 70.31 110.686 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 107.35 -128.22 9.13 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.836 -0.697 . . . . 53.02 112.536 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.732 ' CB ' HD12 ' A' ' 208' ' ' ILE . 0.0 OUTLIER -156.69 82.34 3.34 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.871 0.367 . . . . 71.43 110.753 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.57 -24.57 29.51 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.634 2.223 . . . . 71.3 112.481 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.42 -42.02 96.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.845 0.355 . . . . 75.41 111.027 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -103.53 28.83 6.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 70.25 111.257 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.43 29.8 15.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.268 -0.424 . . . . 73.43 111.023 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.778 HG12 HD11 ' A' ' 139' ' ' LEU . 40.2 mt -90.49 111.68 48.77 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.219 -0.446 . . . . 71.23 111.07 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.21 170.89 19.14 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.527 2.151 . . . . 73.11 112.429 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.7 142.15 96.99 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.641 2.228 . . . . 71.13 112.177 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . 0.402 ' HA ' ' CB ' ' A' ' 194' ' ' PRO . 57.5 m-80 47.82 76.67 0.11 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.356 -0.384 . . . . 70.2 111.116 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.08 113.56 17.91 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.357 -0.383 . . . . 70.12 111.581 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.57 126.84 29.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.134 -0.485 . . . . 41.33 110.253 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.582 HD11 ' CE2' ' A' ' 198' ' ' TYR . 13.0 mt -103.35 109.45 21.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.851 0.358 . . . . 72.13 111.556 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.828 HG23 ' HG3' ' A' ' 191' ' ' GLU . 20.5 m -103.26 136.85 42.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 62.4 110.617 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.627 ' CE1' HD21 ' A' ' 190' ' ' LEU . 29.3 p90 -155.38 176.3 12.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.061 0.458 . . . . 64.35 111.539 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -131.63 135.29 46.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.707 -0.679 . . . . 75.43 110.612 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.714 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.3 t -121.95 149.99 25.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.11 0.481 . . . . 73.41 111.924 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -136.91 110.46 8.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.737 -0.665 . . . . 72.4 110.453 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.735 HD22 ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.93 130.76 43.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.345 . . . . 70.22 110.897 -179.664 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.415 HG23 ' HA ' ' A' ' 133' ' ' CYS . 18.3 t -110.25 -30.13 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.221 -0.445 . . . . 52.25 111.633 -179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -168.86 158.61 8.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.865 0.364 . . . . 62.42 111.069 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.668 HG23 HG12 ' A' ' 131' ' ' VAL . 3.4 mp -142.12 112.12 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 63.32 111.097 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . 0.69 ' O ' HG12 ' A' ' 130' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-O 121.073 0.463 . . . . 73.15 110.826 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 1.043 HG11 HG21 ' A' ' 136' ' ' THR . 33.2 t . . . . . 0 CA--C 1.528 0.128 0 CA-C-O 120.595 0.236 . . . . 64.44 111.044 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.423 ' HD2' ' CD2' ' A' ' 72' ' ' PHE . 92.4 Cg_endo -78.98 139.56 15.36 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.607 2.205 . . . . 71.4 112.428 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -80.62 151.87 28.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.168 -0.469 . . . . 51.22 110.827 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.82 92.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.2 -0.455 . . . . 73.54 111.299 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.89 -35.45 76.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 71.05 111.027 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 2.4 m-90 -114.62 173.68 6.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.087 -0.506 . . . . 72.33 110.866 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.449 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -118.25 154.33 32.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.081 -0.509 . . . . 72.32 110.644 179.774 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.51 HG12 ' HD2' ' A' ' 16' ' ' ARG . 43.7 t -55.13 -34.28 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.353 -0.385 . . . . 51.24 110.927 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -65.01 -32.38 74.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.108 -0.496 . . . . 72.51 110.839 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.449 ' HB2' HG23 ' A' ' 11' ' ' THR . 1.4 tp-100 -82.05 -56.1 4.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.346 -0.388 . . . . 73.24 110.835 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.82 ' HB3' HG22 ' A' ' 60' ' ' VAL . 8.3 mt -50.21 -28.75 8.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.202 -0.454 . . . . 64.32 110.82 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.51 ' HD2' HG12 ' A' ' 12' ' ' VAL . 60.6 mtt180 -94.63 -28.7 15.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.766 -0.652 . . . . 72.43 110.337 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.4 t -53.12 170.2 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.881 -0.6 . . . . 64.11 111.314 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -103.69 17.11 24.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.733 -0.667 . . . . 73.33 111.123 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -113.65 -20.66 11.12 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.489 -0.323 . . . . 72.2 111.357 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.649 HD23 ' N ' ' A' ' 21' ' ' PRO . 6.2 tt -84.78 129.48 56.61 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.591 -0.277 . . . . 73.43 110.959 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.649 ' N ' HD23 ' A' ' 20' ' ' LEU . 73.6 Cg_endo -77.23 125.64 7.97 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.5 2.133 . . . . 55.51 112.255 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -24.1 66.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 70.34 110.952 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.428 ' HA ' HD12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -54.26 -35.21 62.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.282 -0.417 . . . . 62.44 111.465 -179.751 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.26 -54.48 6.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.966 0.413 . . . . 64.25 111.046 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.673 ' O ' HD12 ' A' ' 29' ' ' LEU . 29.1 mt -45.0 -32.9 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 64.04 111.38 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.641 HG12 HD21 ' A' ' 59' ' ' LEU . 6.1 mt -76.51 -49.97 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 54.04 110.925 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.42 ' HE2' HD13 ' A' ' 47' ' ' ILE . 34.8 mttm -64.8 -25.57 67.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.812 -0.631 . . . . 72.44 111.115 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -70.4 -45.38 66.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.997 0.427 . . . . 75.24 110.834 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.764 HD21 ' HA ' ' A' ' 63' ' ' TYR . 3.4 mt -69.97 -36.48 75.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.851 -0.613 . . . . 65.53 110.946 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.495 ' HA ' HD11 ' A' ' 38' ' ' LEU . 38.5 mt-30 -69.59 -20.72 63.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.176 -0.465 . . . . 72.45 110.707 179.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.2 -51.06 5.35 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.148 -0.478 . . . . 72.34 110.963 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -88.87 0.91 56.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 71.52 111.612 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.38 160.45 14.33 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.673 -0.775 . . . . 64.24 112.445 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -92.55 151.87 19.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.547 0.213 . . . . 71.24 110.458 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.685 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -48.94 -57.12 6.98 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.81 0.338 . . . . 54.44 111.176 -179.745 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -47.78 -51.65 21.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.059 0.457 . . . . 61.22 110.842 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.508 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 10.8 t80 -52.76 -47.51 67.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.82 -0.627 . . . . 62.51 110.477 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.495 HD11 ' HA ' ' A' ' 30' ' ' GLN . 11.2 mt -66.32 -40.88 90.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.073 -0.512 . . . . 64.45 110.764 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.804 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.83 -47.51 31.3 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.056 0.455 . . . . 71.13 111.079 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -57.64 -26.91 62.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.765 -0.652 . . . . 74.03 110.895 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 43.9 m-70 -112.63 11.16 19.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.276 -0.42 . . . . 75.12 111.261 179.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt 51.15 35.47 13.3 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.858 0.361 . . . . 64.13 110.93 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.652 HD13 HD13 ' A' ' 29' ' ' LEU . 29.1 mt -94.18 -20.34 19.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.132 -0.485 . . . . 73.45 111.736 -179.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.804 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.69 158.76 26.89 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.046 0.45 . . . . 63.32 111.121 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 114.57 -119.37 4.67 Favored Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 115.798 -0.637 . . . . 75.24 112.404 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.747 ' O ' HG23 ' A' ' 50' ' ' VAL . 5.6 m120 -116.34 113.79 23.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.751 0.31 . . . . 70.13 110.9 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.617 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -45.58 -54.64 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.192 -0.458 . . . . 74.42 111.374 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.27 -36.55 9.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.87 -0.605 . . . . 71.42 110.92 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -85.64 -25.23 26.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.992 -0.549 . . . . 74.21 111.102 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.747 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.7 t -83.45 -25.81 7.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.297 -0.41 . . . . 70.34 111.479 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.0 -15.83 63.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.37 -0.377 . . . . 65.11 111.41 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -95.19 -34.02 12.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.818 0.342 . . . . 73.3 110.999 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.623 HG22 ' HA ' ' A' ' 50' ' ' VAL . 9.8 t -87.94 -30.56 19.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.46 . . . . 65.51 111.081 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.45 125.8 37.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.427 . . . . 73.32 111.132 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.09 174.84 10.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 71.25 110.642 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.627 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -57.77 -58.1 9.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.861 0.363 . . . . 62.43 110.505 179.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.59 -26.99 68.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.121 -0.491 . . . . 75.34 110.573 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.91 -43.4 98.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.095 -0.502 . . . . 70.44 110.475 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.641 HD21 HG12 ' A' ' 26' ' ' ILE . 20.4 mt -73.48 -32.64 64.41 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.713 -0.676 . . . . 73.41 110.973 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.82 HG22 ' HB3' ' A' ' 15' ' ' LEU . 15.9 t -76.9 -42.39 32.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.005 0.431 . . . . 74.11 110.695 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.0 m -60.73 -33.44 72.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.869 -0.605 . . . . 73.34 110.516 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.445 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -81.13 -22.25 39.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.483 . . . . 75.32 111.045 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.764 ' HA ' HD21 ' A' ' 29' ' ' LEU . 14.0 t80 -83.66 -22.9 32.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.099 -0.5 . . . . 73.11 111.126 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -83.95 -54.16 5.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.046 0.45 . . . . 71.22 111.294 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.585 ' HD2' HG21 ' A' ' 69' ' ' THR . 3.1 p-80 -60.78 -31.09 70.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.02 -0.536 . . . . 65.11 111.036 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.648 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.7 tt -46.1 -41.12 11.89 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.899 0.381 . . . . 63.2 111.162 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -78.13 -42.14 32.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.018 -0.537 . . . . 72.34 110.268 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -70.03 -13.07 62.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.853 -0.612 . . . . 70.05 110.933 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.585 HG21 ' HD2' ' A' ' 65' ' ' HIS . 35.8 p -108.72 -16.07 14.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.179 -0.464 . . . . 51.13 111.195 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.29 30.65 17.11 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.793 0.33 . . . . 72.12 110.942 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -96.1 44.27 1.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 74.44 111.047 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.423 ' CD2' ' HD2' ' A' ' 6' ' ' PRO . 75.5 m-85 -66.86 175.95 2.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 65.12 110.696 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 72.23 110.879 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.439 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.784 0.326 . . . . 72.54 110.987 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -152.36 171.5 17.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.307 -0.406 . . . . 73.1 110.88 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . 0.415 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 0.2 OUTLIER -134.52 129.22 34.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 75.41 110.56 179.828 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.41 ' CG ' ' HB3' ' A' ' 190' ' ' LEU . 0.0 OUTLIER -120.32 151.54 39.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 62.41 111.056 -179.776 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.401 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.3 m -150.08 114.1 5.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.144 -0.48 . . . . 71.44 110.875 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.61 ' O ' HG13 ' A' ' 115' ' ' VAL . 9.7 p -80.7 106.6 12.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.249 -0.432 . . . . 75.35 111.134 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.401 HD12 ' O ' ' A' ' 114' ' ' SER . 6.4 mp -78.31 -77.11 0.17 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.476 . . . . 61.51 111.076 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -96.76 110.0 22.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.267 -0.424 . . . . 74.11 111.08 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.2 mtmt -59.43 139.6 56.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 64.32 110.804 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.514 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -111.68 -154.78 12.88 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.682 -0.77 . . . . 24.21 112.659 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -37.29 -52.92 1.09 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.049 0.452 . . . . 44.51 111.412 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 tmtp? 71.85 36.17 1.24 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.793 -0.64 . . . . 71.42 110.234 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -156.91 -44.61 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.791 -0.64 . . . . 73.35 110.775 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -87.59 97.08 10.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.117 -0.492 . . . . 72.53 110.919 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -109.41 154.82 42.04 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.089 -0.505 . . . . 75.13 110.642 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.69 ' HB2' HG21 ' A' ' 166' ' ' VAL . 58.5 Cg_endo -71.59 125.47 11.2 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.515 2.143 . . . . 65.33 112.439 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.1 tttm -92.99 160.22 14.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 75.22 110.899 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -57.89 119.47 6.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.286 -0.415 . . . . 72.14 110.947 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 87.45 1.8 83.21 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.745 -0.74 . . . . 75.11 112.833 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -92.13 139.41 30.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.878 0.37 . . . . 74.33 110.967 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.524 HG22 ' N ' ' A' ' 131' ' ' VAL . 4.4 p -71.66 162.04 4.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.066 -0.515 . . . . 75.03 110.909 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.699 HG12 HG23 ' A' ' 223' ' ' ILE . 9.3 m -154.56 145.58 13.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.042 -0.526 . . . . 52.02 110.987 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.452 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -128.35 117.95 22.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.728 0.299 . . . . 75.05 110.936 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.455 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 29.1 p -154.26 170.3 21.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.919 0.39 . . . . 33.5 111.196 -179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.61 ' HB3' HD11 ' A' ' 149' ' ' ILE . 66.3 m95 -104.19 161.01 14.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.938 -0.574 . . . . 74.52 110.149 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.506 ' OH ' HD13 ' A' ' 162' ' ' LEU . 4.5 p90 -159.5 134.98 8.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.03 0.443 . . . . 73.42 111.702 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 1.043 HG21 HG11 ' A' ' 5' ' ' VAL . 22.5 m -127.83 113.55 16.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 70.52 110.307 179.467 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.601 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.18 144.2 17.06 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.629 -0.796 . . . . 53.53 113.342 -179.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.84 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.44 130.77 13.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.756 0.312 . . . . 62.14 110.457 179.675 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.66 HD21 HG23 ' A' ' 208' ' ' ILE . 91.3 mt -66.02 -178.0 0.56 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.395 -0.366 . . . . 70.13 110.849 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -56.7 -42.3 78.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 75.33 110.76 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.46 -5.22 56.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.97 -0.559 . . . . 73.11 111.395 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 95.89 25.76 12.62 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.624 -0.798 . . . . 65.12 112.634 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . 0.645 ' HB ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -80.89 113.02 18.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.876 0.37 . . . . 72.1 110.837 180.0 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.479 ' CG2' HG23 ' A' ' 147' ' ' THR . 11.3 p -71.6 121.42 21.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 73.42 111.136 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.442 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 53.3 p90 -113.28 -17.08 12.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 50.33 111.315 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.09 127.52 7.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.797 0.332 . . . . 73.42 110.951 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.874 HG22 HG23 ' A' ' 136' ' ' THR . 1.0 OUTLIER -142.87 98.01 3.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 73.22 111.005 -179.992 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -77.26 -9.16 58.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.224 -0.444 . . . . 73.52 111.075 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.693 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.5 mp . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.383 -0.371 . . . . 51.32 110.962 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.796 0.331 . . . . 74.41 111.092 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -129.83 128.4 22.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 74.22 110.89 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.09 148.2 40.65 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.411 2.074 . . . . 74.2 112.314 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.506 HD13 ' OH ' ' A' ' 135' ' ' TYR . 0.3 OUTLIER -73.47 120.76 19.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 50.54 110.532 179.797 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.644 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -103.55 122.7 45.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.944 0.402 . . . . 64.34 111.336 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.655 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 25.2 p90 -153.74 145.58 23.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.002 -0.544 . . . . 74.44 110.637 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.452 ' HB3' HG21 ' A' ' 168' ' ' VAL . 60.9 mttt -80.75 138.49 36.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.128 0.489 . . . . 73.3 111.29 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.69 HG21 ' HB2' ' A' ' 125' ' ' PRO . 17.8 m -87.27 149.35 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.652 -0.704 . . . . 73.24 111.05 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.0 23.7 76.91 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.777 -0.725 . . . . 73.22 112.408 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.452 HG21 ' HB3' ' A' ' 165' ' ' LYS . 0.8 OUTLIER -132.55 39.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.939 0.4 . . . . 62.32 110.926 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 47.36 38.77 13.34 Favored Glycine 0 C--N 1.33 0.202 0 C-N-CA 121.02 -0.609 . . . . 61.22 112.85 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.5 -47.05 11.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.915 0.388 . . . . 72.4 110.872 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . 0.466 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.2 OUTLIER -120.08 -179.68 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.96 -0.564 . . . . 74.35 111.022 179.898 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.522 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 4.0 pt -59.64 161.02 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.32 -0.4 . . . . 73.22 111.285 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -69.07 -27.88 66.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 75.2 110.986 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.83 -37.75 38.29 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.673 -0.775 . . . . 62.3 112.03 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.695 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.7 t90 -78.44 -33.43 48.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.921 0.391 . . . . 74.44 111.09 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -69.05 -29.05 67.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.973 -0.558 . . . . 64.41 110.695 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -81.76 -28.72 33.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 75.42 110.827 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.568 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -85.27 -51.55 6.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.277 -0.42 . . . . 73.24 111.212 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.655 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 2.9 mt -54.39 -36.71 64.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.991 -0.55 . . . . 75.12 110.773 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 3.1 tp -54.15 -25.02 20.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 70.24 110.996 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.16 -0.0 57.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 60.11 111.445 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 23.2 mmm -80.54 150.14 29.7 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.867 0.365 . . . . 55.31 110.909 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.52 171.08 8.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.104 -0.498 . . . . 71.31 111.18 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . 0.511 ' HA ' HD22 ' A' ' 220' ' ' LEU . 3.6 tttt -62.7 117.1 5.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.037 -0.529 . . . . 63.13 110.68 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . 0.401 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 69.07 65.63 2.54 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.617 -0.802 . . . . 72.41 112.398 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . 0.514 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.5 tt0 -145.05 145.14 31.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.663 0.268 . . . . 63.0 110.503 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.9 ttpt -118.36 135.88 54.06 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.194 -0.299 . . . . 70.34 110.194 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -144.43 172.82 12.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.125 0.488 . . . . 73.31 111.864 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.52 118.22 14.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.53 -0.759 . . . . 71.53 109.817 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.696 HD21 ' CE1' ' A' ' 216' ' ' PHE . 2.1 pt? -128.73 139.84 52.02 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.016 0.436 . . . . 65.24 111.795 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.559 ' HB3' HG23 ' A' ' 215' ' ' THR . 0.0 OUTLIER -117.79 114.87 23.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.792 -0.64 . . . . 75.24 110.544 179.549 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.449 HD13 HD11 ' A' ' 172' ' ' ILE . 3.1 mt -105.0 142.43 18.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.229 -0.441 . . . . 61.25 111.521 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.433 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.3 OUTLIER -72.05 168.57 21.78 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.907 -0.588 . . . . 74.25 110.592 179.818 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . 0.433 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 24.7 Cg_endo -61.93 -35.07 79.56 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.352 2.035 . . . . 61.03 112.224 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -60.37 -39.91 88.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 71.12 111.099 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.439 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 16.8 m0 -96.98 36.87 1.36 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.343 -0.39 . . . . 64.0 110.974 -179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -160.8 -78.45 0.05 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.067 -0.515 . . . . 61.34 110.742 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . 0.589 ' CE2' HD13 ' A' ' 208' ' ' ILE . 36.0 m-85 -105.98 -71.25 0.75 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 74.34 110.535 179.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 141.03 -177.21 21.11 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.815 -0.707 . . . . 32.35 112.85 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 18.4 mttm -59.21 -34.65 72.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.816 0.341 . . . . 72.43 110.932 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -61.57 -52.8 62.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 50.02 110.64 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 97.17 173.6 34.29 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.874 -0.679 . . . . 73.22 112.551 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.425 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.3 OUTLIER -111.23 93.51 18.61 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.654 0.264 . . . . 75.14 110.743 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.97 -26.37 51.32 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.527 2.151 . . . . 64.43 112.443 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -60.86 -42.18 97.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.946 0.403 . . . . 74.43 110.849 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -99.21 27.43 5.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.043 -0.526 . . . . 75.34 111.231 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.1 29.44 14.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.27 -0.423 . . . . 74.02 111.038 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.66 HG23 HD21 ' A' ' 139' ' ' LEU . 40.6 mt -94.14 111.46 53.39 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.317 -0.401 . . . . 62.52 110.987 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.33 172.32 6.65 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.554 2.169 . . . . 74.21 112.25 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.2 128.64 12.31 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.612 2.208 . . . . 72.33 112.241 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 63.26 69.54 0.57 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.3 -0.409 . . . . 53.14 110.711 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.68 156.98 34.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 43.13 111.39 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -88.57 141.72 28.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.962 -0.563 . . . . 53.33 110.381 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.457 HD11 ' CD2' ' A' ' 198' ' ' TYR . 3.5 mt -125.68 109.07 12.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.379 . . . . 70.33 111.518 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.559 HG23 ' HB3' ' A' ' 191' ' ' GLU . 4.3 m -113.07 142.9 45.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.953 -0.567 . . . . 44.42 110.511 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.696 ' CE1' HD21 ' A' ' 190' ' ' LEU . 18.4 p90 -155.08 -179.86 8.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.438 . . . . 74.54 111.371 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -132.53 135.96 46.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.702 -0.681 . . . . 73.4 110.409 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.695 HG21 ' HE1' ' A' ' 175' ' ' TRP . 4.2 t -121.14 150.9 24.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.098 0.475 . . . . 64.42 111.809 -178.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -136.74 107.96 6.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.654 -0.703 . . . . 72.21 110.163 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.736 HD21 HG13 ' A' ' 223' ' ' ILE . 2.3 tt -69.99 130.0 41.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.426 -0.352 . . . . 64.44 110.809 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 24.7 t -108.8 -30.14 2.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.253 -0.43 . . . . 73.23 111.423 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . 0.431 ' N ' HD23 ' A' ' 220' ' ' LEU . 7.8 t70 -170.0 160.16 8.1 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.901 0.381 . . . . 64.44 111.236 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.736 HG13 HD21 ' A' ' 220' ' ' LEU . 31.9 mt -142.83 111.82 2.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.03 -0.532 . . . . 54.35 111.014 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . 0.434 ' C ' HG12 ' A' ' 130' ' ' VAL . 1.1 m-20 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.243 -0.435 . . . . 74.43 110.902 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.939 HG11 HG21 ' A' ' 136' ' ' THR . 40.0 t . . . . . 0 CA--C 1.529 0.139 0 CA-C-O 120.515 0.197 . . . . 41.45 110.846 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.451 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 88.9 Cg_endo -80.9 140.2 12.6 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.622 2.215 . . . . 72.05 112.623 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -83.87 154.62 23.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 62.42 110.863 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.57 89.92 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.114 -0.493 . . . . 65.42 111.47 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.83 -32.38 67.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 62.4 111.18 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.557 ' NE1' HD11 ' A' ' 20' ' ' LEU . 1.9 m-90 -118.63 173.86 6.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 74.33 110.927 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.465 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -116.66 153.08 32.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.962 -0.563 . . . . 70.25 110.424 179.542 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.408 HG12 ' HD2' ' A' ' 16' ' ' ARG . 24.1 t -55.96 -33.74 36.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.926 0.394 . . . . 55.11 111.009 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -71.13 -27.67 63.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.986 -0.552 . . . . 72.03 111.286 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.465 ' HB2' HG23 ' A' ' 11' ' ' THR . 0.0 OUTLIER -82.34 -56.38 3.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.811 0.339 . . . . 73.35 111.208 -179.82 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.763 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.2 mt -49.51 -65.07 0.63 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.245 -0.434 . . . . 61.12 111.228 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.408 ' HD2' HG12 ' A' ' 12' ' ' VAL . 16.0 mtt180 -53.55 -25.1 15.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 71.21 111.258 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.69 172.72 0.16 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.941 0.401 . . . . 72.31 111.239 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -110.3 16.84 21.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.92 -0.582 . . . . 53.4 111.254 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -111.34 -23.58 10.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.568 -0.287 . . . . 71.52 111.224 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.849 HD22 HD11 ' A' ' 25' ' ' ILE . 10.1 tt -87.12 116.52 66.35 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.458 -0.337 . . . . 62.25 110.921 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.45 123.27 13.22 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.384 2.056 . . . . 55.45 112.237 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.4 -24.11 66.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 72.23 111.308 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -53.16 -35.24 59.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.421 -0.354 . . . . 64.23 111.295 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -77.56 -49.74 14.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.287 -0.415 . . . . 72.11 110.921 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.849 HD11 HD22 ' A' ' 20' ' ' LEU . 25.1 mt -47.03 -36.91 3.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.898 -0.592 . . . . 72.23 111.246 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.736 HG12 HD21 ' A' ' 59' ' ' LEU . 10.7 mt -72.04 -49.26 45.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 42.31 110.848 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.539 ' HG3' HD11 ' A' ' 47' ' ' ILE . 0.7 OUTLIER -57.23 -23.43 48.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.69 -0.687 . . . . 71.42 111.098 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -74.23 -49.78 21.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.002 0.43 . . . . 73.5 111.061 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.789 HD21 ' HA ' ' A' ' 63' ' ' TYR . 3.5 mt -66.3 -28.55 68.77 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.872 -0.603 . . . . 44.44 111.291 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -76.21 -28.01 57.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.52 -0.309 . . . . 64.44 111.016 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.423 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 10.7 pt-20 -89.91 -38.48 13.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.832 0.348 . . . . 71.32 110.817 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.451 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 42.4 m170 -100.49 16.61 24.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 64.32 110.982 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.6 152.11 21.49 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.831 -0.7 . . . . 63.44 112.512 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.8 p -92.73 156.52 16.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.642 0.258 . . . . 75.42 110.604 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.438 ' HA ' HD21 ' A' ' 44' ' ' LEU . 1.4 m-20 -48.0 -54.68 12.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.765 0.316 . . . . 65.23 111.31 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 82.5 p -51.06 -46.69 61.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.023 0.439 . . . . 75.33 110.695 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 22.2 t80 -57.11 -48.18 79.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.745 -0.661 . . . . 64.14 110.775 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.751 HD22 ' HB3' ' A' ' 43' ' ' LEU . 11.8 mt -63.24 -46.87 84.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 71.53 110.909 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.913 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -49.46 -31.05 9.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 41.25 111.243 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -72.92 -32.46 65.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 71.21 111.073 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.707 ' ND1' ' HB2' ' A' ' 62' ' ' ALA . 6.7 m-70 -110.14 12.14 23.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.377 -0.374 . . . . 75.44 111.548 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 59.96 32.13 20.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.747 0.308 . . . . 70.32 111.01 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.751 ' HB3' HD22 ' A' ' 38' ' ' LEU . 15.5 mt -85.93 -22.05 27.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.257 -0.429 . . . . 74.12 111.042 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.913 HD11 ' HB2' ' A' ' 39' ' ' ALA . 92.4 mt -48.01 170.47 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.931 0.396 . . . . 63.11 111.234 179.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.88 -160.13 32.15 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.846 -0.692 . . . . 63.23 112.796 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.877 ' O ' HG23 ' A' ' 50' ' ' VAL . 36.7 m-80 -102.62 147.11 27.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.963 0.411 . . . . 72.44 111.065 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.587 HG23 HD12 ' A' ' 26' ' ' ILE . 3.3 mp -45.36 -43.59 3.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.889 -0.596 . . . . 74.34 111.513 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -43.15 72.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.981 -0.554 . . . . 73.35 111.047 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -85.68 -28.95 24.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.956 -0.565 . . . . 73.24 111.22 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.877 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.8 t -73.01 -27.57 24.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.299 -0.41 . . . . 74.14 111.454 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.51 -25.86 66.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.427 -0.351 . . . . 54.35 111.359 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.25 -27.38 15.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.287 -0.415 . . . . 75.31 111.244 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.4 m -84.33 -21.43 30.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.353 -0.385 . . . . 74.33 111.414 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -120.58 131.48 54.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.795 0.331 . . . . 72.13 111.349 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -77.81 -178.12 5.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 52.2 110.474 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.465 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -61.28 -58.42 8.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.816 0.341 . . . . 72.53 110.536 179.962 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.24 -26.72 67.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.143 -0.481 . . . . 72.45 110.664 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.67 -37.95 83.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.108 0.48 . . . . 72.4 110.249 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.736 HD21 HG12 ' A' ' 26' ' ' ILE . 14.2 mt -76.25 -31.71 58.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.614 -0.721 . . . . 73.11 110.955 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.763 HG22 ' HB3' ' A' ' 15' ' ' LEU . 15.1 t -78.46 -42.81 26.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.051 0.453 . . . . 71.34 110.705 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 32.8 m -59.27 -35.6 74.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.842 -0.617 . . . . 72.51 110.493 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.707 ' HB2' ' ND1' ' A' ' 41' ' ' HIS . . . -81.76 -20.85 38.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.024 -0.535 . . . . 74.24 110.957 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.789 ' HA ' HD21 ' A' ' 29' ' ' LEU . 8.2 t80 -83.67 -22.99 31.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.194 -0.457 . . . . 71.52 110.86 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.508 ' ND2' HG12 ' A' ' 60' ' ' VAL . 37.1 m-80 -85.6 -53.91 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 74.24 111.369 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.449 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.2 p-80 -60.99 -28.29 68.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.111 -0.495 . . . . 73.43 111.136 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.67 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.8 tt -50.27 -40.51 48.35 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.977 0.417 . . . . 62.22 110.973 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.418 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.4 m-85 -78.95 -37.48 39.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.892 -0.594 . . . . 63.31 110.578 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.04 -40.47 91.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.893 -0.594 . . . . 74.31 110.999 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.01 -9.53 48.29 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.076 -0.511 . . . . 71.54 111.278 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.59 33.73 19.79 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.741 0.305 . . . . 74.23 111.244 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -90.56 46.29 1.32 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.387 -0.37 . . . . 74.15 111.078 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.428 ' CE2' ' HD2' ' A' ' 6' ' ' PRO . 93.3 m-85 -67.32 169.77 8.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.293 -0.412 . . . . 75.25 110.742 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.1 ttmm . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.329 -0.396 . . . . 61.43 110.861 179.889 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.865 0.364 . . . . 75.52 110.893 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 6.2 p90 -173.03 153.82 2.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 53.53 110.897 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 19.7 m -115.85 130.55 56.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.276 -0.42 . . . . 72.22 110.327 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.527 ' HE2' HG22 ' A' ' 115' ' ' VAL . 4.6 tttt -127.65 144.85 51.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.926 0.393 . . . . 74.52 111.227 -179.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.3 m -142.51 119.81 11.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 74.52 110.681 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.527 HG22 ' HE2' ' A' ' 113' ' ' LYS . 27.5 t -80.29 106.36 11.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.431 . . . . 73.22 111.211 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.532 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -79.33 -49.36 12.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.214 -0.448 . . . . 71.1 110.795 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -121.8 107.99 12.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 75.34 110.957 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.6 mttm -63.03 143.63 57.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.223 -0.444 . . . . 71.44 110.895 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -106.15 -165.05 23.0 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.687 -0.768 . . . . 65.13 112.409 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -36.56 -42.57 0.36 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.846 0.355 . . . . 64.22 111.826 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.6 tttt 74.55 42.22 0.31 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.135 -0.484 . . . . 74.54 110.582 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 69.1 m -164.26 -43.37 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.946 -0.57 . . . . 62.12 110.722 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -86.83 101.12 13.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 72.11 110.911 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -120.24 147.67 45.47 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 72.23 110.834 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.456 ' CB ' HG21 ' A' ' 166' ' ' VAL . 50.7 Cg_exo -54.37 127.63 26.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.56 2.174 . . . . 54.2 112.547 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.56 ' O ' HG23 ' A' ' 166' ' ' VAL . 1.1 mttp -99.18 152.19 20.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 74.31 110.706 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.48 114.05 1.52 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.335 -0.393 . . . . 74.53 111.114 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 93.44 -2.37 70.64 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.762 -0.732 . . . . 62.45 112.982 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -92.15 137.77 32.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.919 0.39 . . . . 71.0 111.071 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.518 HG22 ' N ' ' A' ' 131' ' ' VAL . 7.5 p -70.05 161.27 4.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.078 -0.51 . . . . 75.52 110.971 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.751 HG12 HG23 ' A' ' 223' ' ' ILE . 5.5 m -153.58 144.71 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 72.22 111.07 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.475 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.96 117.75 22.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.543 -0.299 . . . . 65.13 110.805 179.753 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.5 ' HA ' HG23 ' A' ' 221' ' ' VAL . 30.2 p -150.12 168.09 24.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.0 0.429 . . . . 53.14 111.182 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.718 ' HB3' HD11 ' A' ' 149' ' ' ILE . 51.3 m95 -101.89 157.76 16.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.813 -0.63 . . . . 73.11 109.747 179.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.471 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 49.8 p90 -162.45 139.06 7.78 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.296 -0.561 . . . . 64.15 112.22 -179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.939 HG21 HG11 ' A' ' 5' ' ' VAL . 81.1 m -129.26 112.48 13.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.466 -0.788 . . . . 71.24 110.457 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.648 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.73 146.15 18.11 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.598 -0.81 . . . . 62.23 113.184 -179.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.635 HG23 HG12 ' A' ' 144' ' ' VAL . 0.0 OUTLIER -152.21 147.1 26.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.789 0.328 . . . . 74.21 110.833 179.815 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.686 HD21 HD12 ' A' ' 208' ' ' ILE . 41.4 mt -80.5 -178.37 6.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 74.14 110.694 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -56.92 -43.82 81.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.901 0.382 . . . . 71.13 111.018 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.7 -6.61 47.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.996 -0.547 . . . . 65.4 111.462 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 92.43 20.45 35.04 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.666 -0.778 . . . . 63.54 112.729 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.48 113.8 25.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 73.11 110.675 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.635 HG12 HG23 ' A' ' 138' ' ' THR . 5.7 m -63.68 138.5 22.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 64.04 111.134 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.675 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 40.3 p90 -117.81 -40.96 2.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 60.45 110.929 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -154.53 115.2 3.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.067 -0.515 . . . . 75.03 110.715 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.406 ' CB ' ' HA ' ' A' ' 136' ' ' THR . 6.9 t -142.76 126.97 17.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.302 -0.408 . . . . 64.4 111.237 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.502 ' O ' HD13 ' A' ' 149' ' ' ILE . 22.3 t30 -89.01 55.44 3.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.196 0.522 . . . . 73.32 109.915 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.718 HD11 ' HB3' ' A' ' 134' ' ' TRP . 45.3 mm . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.74 -0.664 . . . . 74.41 111.05 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.437 ' HB1' ' HH2' ' A' ' 134' ' ' TRP . . . . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.848 0.356 . . . . 73.24 111.094 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.4 tttt -146.34 116.06 4.65 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.446 . . . . 43.34 110.855 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . 0.42 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 53.8 Cg_exo -52.41 155.05 10.31 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.376 2.05 . . . . 65.54 112.258 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.65 117.83 16.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 75.12 110.517 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.637 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -100.6 123.31 44.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.939 0.399 . . . . 72.13 111.474 -179.733 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.704 ' O ' HG22 ' A' ' 131' ' ' VAL . 11.7 p90 -153.38 145.41 23.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.965 -0.561 . . . . 73.31 110.528 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.601 ' O ' HG22 ' A' ' 168' ' ' VAL . 9.6 mtpt -81.17 138.9 35.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.136 0.493 . . . . 75.33 111.248 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 126' ' ' LYS . 6.2 m -87.3 149.37 4.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.566 -0.743 . . . . 63.5 111.128 -179.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.63 22.82 78.04 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.836 -0.697 . . . . 74.34 112.6 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 165' ' ' LYS . 28.0 m -131.24 40.52 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.35 . . . . 65.42 111.111 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.52 38.06 6.94 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 121.071 -0.585 . . . . 53.03 113.135 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.51 -47.0 11.81 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.94 0.4 . . . . 64.22 110.983 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . 0.467 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.3 OUTLIER -119.0 -179.48 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.001 -0.545 . . . . 64.21 111.026 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.537 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.8 158.89 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.316 -0.402 . . . . 73.33 111.281 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 17.0 ttm105 -67.73 -27.88 67.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.271 -0.422 . . . . 75.13 110.965 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.1 -38.06 48.17 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.694 -0.765 . . . . 72.11 111.881 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.775 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.2 t90 -78.6 -33.0 47.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.993 0.425 . . . . 74.11 110.883 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . 0.402 ' O ' HD13 ' A' ' 180' ' ' LEU . 35.9 t70 -64.91 -32.17 73.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.877 -0.601 . . . . 72.24 110.538 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -80.84 -28.93 35.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.055 -0.52 . . . . 71.31 110.665 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.533 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -80.7 -56.36 4.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 65.33 111.059 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.691 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 6.2 mt -56.01 -31.3 62.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.924 -0.58 . . . . 61.44 110.797 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.402 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.4 tp -53.41 -28.88 32.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.085 -0.507 . . . . 72.34 111.344 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 27.1 p -105.65 4.59 30.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.372 -0.376 . . . . 74.52 111.793 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.474 ' O ' HD13 ' A' ' 220' ' ' LEU . 5.3 mtp -74.33 101.98 4.23 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.903 0.383 . . . . 75.15 110.89 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.9 161.39 18.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.927 -0.579 . . . . 72.3 111.409 -179.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . 0.642 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -60.86 117.65 5.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.56 -0.745 . . . . 74.13 111.2 -179.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 81.65 10.42 84.33 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.869 -0.682 . . . . 64.05 113.137 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -86.18 151.07 23.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 71.21 111.27 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -127.42 138.16 52.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.998 -0.546 . . . . 64.4 109.976 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.05 172.5 13.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.226 0.536 . . . . 75.34 112.147 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.82 101.09 4.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.391 -0.822 . . . . 75.13 109.715 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.533 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.6 pt? -122.18 147.94 45.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.121 0.486 . . . . 70.1 111.881 -179.04 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.619 ' HB3' HG23 ' A' ' 215' ' ' THR . 10.5 pt-20 -120.47 120.53 36.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.705 -0.68 . . . . 64.12 110.564 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.471 ' CD1' ' CZ ' ' A' ' 216' ' ' PHE . 5.0 mp -100.49 139.46 21.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 64.55 111.347 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -77.0 164.88 56.41 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.933 -0.576 . . . . 72.21 110.756 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . 0.41 ' HG3' ' N ' ' A' ' 212' ' ' ALA . 53.1 Cg_exo -54.93 -42.0 73.25 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.588 2.192 . . . . 72.34 112.303 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -52.29 -30.41 27.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 72.03 111.379 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.461 ' O ' HG21 ' A' ' 192' ' ' ILE . 23.7 m0 -115.6 36.95 3.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.404 -0.362 . . . . 74.32 111.227 -179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -154.93 -85.2 0.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.447 -0.342 . . . . 71.41 111.25 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . 0.519 ' HD2' HG21 ' A' ' 208' ' ' ILE . 28.7 m-85 -107.55 -33.47 7.32 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.043 0.449 . . . . 75.42 110.624 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 109.29 173.1 20.95 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.912 -0.661 . . . . 31.11 112.821 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -32.57 70.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.788 0.328 . . . . 62.04 110.831 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -56.78 -54.71 43.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.203 -0.453 . . . . 64.33 110.643 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 117.87 -162.4 13.08 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.833 -0.699 . . . . 72.02 112.673 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.438 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 1.6 tm0? -153.02 84.99 4.37 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.85 0.357 . . . . 70.23 110.355 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -48.67 -49.67 14.26 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.803 2.335 . . . . 71.34 113.048 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -50.93 -42.32 59.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.914 0.388 . . . . 72.14 111.088 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.675 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -95.65 26.75 3.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.033 -0.53 . . . . 73.35 111.384 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 4.0 mptt 47.84 30.68 1.99 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.83 0.348 . . . . 65.44 111.075 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.686 HD12 HD21 ' A' ' 139' ' ' LEU . 22.7 mm -92.81 111.71 52.48 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 74.25 111.28 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . 0.567 ' HG2' ' HB2' ' A' ' 212' ' ' ALA . 74.4 Cg_endo -74.99 160.88 39.67 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.414 2.076 . . . . 75.31 112.17 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -51.33 115.3 1.98 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.473 2.115 . . . . 71.3 112.298 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 66.24 73.53 0.37 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.232 -0.44 . . . . 62.34 110.912 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . 0.567 ' HB2' ' HG2' ' A' ' 209' ' ' PRO . . . -126.22 124.68 40.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.248 -0.433 . . . . 74.03 111.329 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 3.8 tptm -65.67 151.82 45.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.106 -0.497 . . . . 72.51 110.578 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 6.1 mt -130.48 109.42 10.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.814 0.34 . . . . 70.33 111.405 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.619 HG23 ' HB3' ' A' ' 191' ' ' GLU . 3.8 m -106.38 139.72 40.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 62.53 110.573 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.648 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 6.4 p90 -156.44 178.75 9.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.107 0.48 . . . . 62.31 111.514 -179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -133.01 137.13 46.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.613 -0.721 . . . . 74.34 110.279 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.775 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.3 t -124.15 151.26 29.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.107 0.48 . . . . 54.35 112.086 -178.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -136.88 110.98 8.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.598 -0.728 . . . . 61.25 110.132 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.792 HD21 HG13 ' A' ' 223' ' ' ILE . 2.9 tt -70.83 128.04 34.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.84 0.352 . . . . 70.11 110.988 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.5 HG23 ' HA ' ' A' ' 133' ' ' CYS . 15.5 t -104.97 -30.43 2.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.125 -0.488 . . . . 60.12 111.571 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -171.21 162.46 6.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.867 0.365 . . . . 74.31 111.239 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.792 HG13 HD21 ' A' ' 220' ' ' LEU . 30.2 mt -143.49 112.23 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.006 -0.543 . . . . 64.15 110.964 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . 0.491 ' C ' HG12 ' A' ' 130' ' ' VAL . 3.3 m-20 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 72.44 110.89 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 1.091 HG11 HG21 ' A' ' 136' ' ' THR . 38.5 t . . . . . 0 CA--C 1.528 0.123 0 CA-C-O 120.661 0.267 . . . . 73.32 111.217 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -77.12 132.89 13.04 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.731 2.287 . . . . 72.25 112.401 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.8 ' OE1' HD11 ' A' ' 149' ' ' ILE . 7.2 mm100 -79.79 146.54 32.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 71.12 110.943 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.523 ' HE ' HG23 ' A' ' 149' ' ' ILE . 0.0 OUTLIER -50.81 115.63 1.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.036 -0.529 . . . . 74.32 111.192 -179.829 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.43 ' HB2' ' NZ ' ' A' ' 187' ' ' LYS . . . -89.25 -39.39 13.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.226 -0.443 . . . . 70.11 110.871 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.517 ' NE1' HD21 ' A' ' 20' ' ' LEU . 1.5 m-90 -104.36 160.05 15.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.023 -0.535 . . . . 72.14 110.703 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 m -99.26 151.87 20.55 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.048 -0.524 . . . . 60.1 110.533 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.635 ' HA ' HD12 ' A' ' 15' ' ' LEU . 44.0 t -56.67 -37.0 50.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.922 0.392 . . . . 75.52 110.437 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.403 ' O ' ' HB2' ' A' ' 17' ' ' SER . 2.1 tt0 -66.02 -27.4 68.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.962 -0.563 . . . . 72.54 110.86 179.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.544 ' OE1' HD23 ' A' ' 20' ' ' LEU . 6.3 mt-30 -80.08 -54.53 5.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.985 -0.552 . . . . 73.21 111.564 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.756 ' HB3' HG22 ' A' ' 60' ' ' VAL . 2.0 mt -50.07 -66.69 0.35 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.727 0.298 . . . . 71.33 111.797 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 12' ' ' VAL . 1.5 ptm180 -60.59 -26.21 66.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.383 -0.371 . . . . 71.31 111.371 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.433 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.4 OUTLIER -50.85 177.28 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.928 0.394 . . . . 55.51 111.273 -179.92 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.19 16.68 21.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.946 -0.57 . . . . 74.31 111.107 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -117.6 -19.32 9.44 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.418 -0.356 . . . . 71.13 111.273 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 1.122 HD12 HD11 ' A' ' 25' ' ' ILE . 1.6 tm? -84.58 121.74 74.87 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.508 -0.315 . . . . 64.43 110.852 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.656 ' HD2' HD22 ' A' ' 20' ' ' LEU . 43.7 Cg_endo -67.84 123.25 10.49 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.428 2.086 . . . . 62.34 112.369 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.624 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -66.15 -24.23 66.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.11 -0.495 . . . . 61.33 111.403 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -53.43 -45.56 69.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.411 -0.358 . . . . 75.34 111.494 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.98 -23.29 48.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.162 -0.472 . . . . 71.43 111.475 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 1.122 HD11 HD12 ' A' ' 20' ' ' LEU . 57.1 mt -70.74 -43.22 77.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.925 0.393 . . . . 74.23 111.127 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.744 ' HB ' HG23 ' A' ' 47' ' ' ILE . 4.0 mt -68.72 -40.19 81.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.017 -0.538 . . . . 73.43 111.102 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -67.18 -25.83 66.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.001 -0.545 . . . . 75.04 111.062 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -70.04 -43.76 70.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.033 0.444 . . . . 54.05 110.875 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.562 HD21 ' HA ' ' A' ' 63' ' ' TYR . 2.8 mt -72.79 -21.35 61.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.888 -0.597 . . . . 74.42 111.04 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -82.68 -24.13 33.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.412 -0.358 . . . . 75.0 111.029 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.82 1.65 31.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.374 -0.375 . . . . 72.42 111.417 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -131.86 -10.66 3.45 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.687 0.255 . . . . 71.51 111.687 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.81 167.66 12.48 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.738 -0.744 . . . . 51.31 112.41 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.7 p -93.86 149.87 20.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.58 0.229 . . . . 74.12 110.489 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.624 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -48.07 -56.98 6.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.807 0.337 . . . . 74.55 110.994 -179.75 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.2 m -48.41 -50.7 29.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 72.15 110.832 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.512 ' CE2' HD12 ' A' ' 66' ' ' LEU . 17.6 t80 -54.06 -48.03 71.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.853 -0.612 . . . . 70.43 110.492 179.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.411 HD22 ' HB3' ' A' ' 43' ' ' LEU . 13.2 mt -66.71 -41.79 87.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.094 -0.503 . . . . 72.31 110.784 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.808 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.57 -47.71 28.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.989 0.423 . . . . 63.43 111.206 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -57.51 -27.22 62.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.812 -0.631 . . . . 74.44 110.982 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -112.53 9.81 19.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.314 -0.403 . . . . 62.01 111.231 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.4 37.77 28.27 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.94 0.4 . . . . 64.32 110.664 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.696 HD21 HD23 ' A' ' 59' ' ' LEU . 17.7 mt -95.94 -19.74 19.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.986 -0.552 . . . . 61.44 111.851 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.808 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -82.11 155.76 24.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.078 0.466 . . . . 71.33 111.101 -179.853 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.37 -122.63 5.5 Favored Glycine 0 N--CA 1.452 -0.292 0 CA-C-N 115.648 -0.705 . . . . 74.43 112.429 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.667 ' O ' HG23 ' A' ' 50' ' ' VAL . 6.0 m-80 -116.34 115.43 25.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.736 0.303 . . . . 63.45 111.059 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.744 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.5 mp -44.85 -53.5 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.178 -0.465 . . . . 75.1 111.447 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.56 -37.2 7.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.868 -0.605 . . . . 75.44 111.05 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -85.69 -26.58 25.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 72.11 111.255 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.667 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.4 t -82.79 -26.56 8.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.432 -0.349 . . . . 71.52 111.597 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.95 -17.85 64.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.427 -0.351 . . . . 61.34 111.454 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 ptpt -95.06 -31.96 13.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.445 -0.343 . . . . 71.2 111.09 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -87.88 -33.68 18.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.24 -0.436 . . . . 75.21 111.131 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -91.21 128.58 37.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.29 -0.414 . . . . 71.21 111.239 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -84.88 178.63 7.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 53.1 110.678 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.576 ' O ' HG23 ' A' ' 60' ' ' VAL . 2.4 tptt -60.03 -58.1 10.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.91 0.386 . . . . 75.34 110.653 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -27.4 69.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.072 -0.513 . . . . 63.54 110.522 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.02 -41.45 96.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 32.13 110.431 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.696 HD23 HD21 ' A' ' 43' ' ' LEU . 20.3 mt -75.55 -30.15 59.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.7 -0.682 . . . . 74.52 110.99 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.756 HG22 ' HB3' ' A' ' 15' ' ' LEU . 18.8 t -78.26 -42.91 27.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.305 -0.407 . . . . 73.5 110.93 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.7 m -61.98 -33.92 75.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.948 -0.569 . . . . 72.43 110.792 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.423 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -80.86 -23.49 39.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 62.14 111.107 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.562 ' HA ' HD21 ' A' ' 29' ' ' LEU . 71.8 t80 -83.66 -22.86 32.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 74.11 110.953 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.406 ' ND2' HG12 ' A' ' 60' ' ' VAL . 20.4 m-80 -82.88 -54.65 4.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.048 -0.524 . . . . 63.54 111.373 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.487 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 3.4 p-80 -63.0 -26.0 68.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.072 -0.513 . . . . 74.32 111.433 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.668 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.6 tt -54.57 -39.04 67.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.847 0.356 . . . . 73.1 111.026 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.422 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 5.2 m-85 -78.98 -38.16 37.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.106 -0.497 . . . . 70.32 110.574 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.63 -40.53 84.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.97 -0.559 . . . . 70.03 110.78 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 75.1 p -90.34 -4.66 56.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.95 -0.568 . . . . 72.13 111.467 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 48.36 37.73 9.19 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.703 0.287 . . . . 55.5 111.287 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.433 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 41.2 mtt180 -94.25 44.03 1.11 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.38 -0.373 . . . . 75.25 111.115 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.419 ' HA ' HD21 ' A' ' 66' ' ' LEU . 81.5 m-85 -65.69 -178.29 0.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 62.42 110.783 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.289 -0.414 . . . . 63.13 110.948 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.441 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.757 0.313 . . . . 74.54 110.987 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 45.0 p90 -154.89 -176.81 6.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 74.43 110.81 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -161.46 104.93 1.26 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.332 -0.394 . . . . 61.14 110.733 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.405 ' HB2' ' CD1' ' A' ' 190' ' ' LEU . 2.7 ptmm? -98.46 151.4 20.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.983 0.42 . . . . 72.23 111.241 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 2.1 m -148.61 111.67 4.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.887 -0.597 . . . . 74.51 110.391 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 26.1 t -73.58 106.29 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.305 -0.407 . . . . 75.52 111.324 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.822 HD12 ' HA ' ' A' ' 188' ' ' ALA . 3.5 mp -75.54 -32.02 60.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 63.24 110.508 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.7 tttt -140.35 110.47 6.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.036 -0.529 . . . . 62.24 110.668 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.0 tptt -57.99 134.76 56.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.262 -0.426 . . . . 71.44 110.968 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.513 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -108.63 -155.08 17.23 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.713 -0.756 . . . . 75.32 112.425 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -36.07 -53.44 0.78 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.008 0.432 . . . . 63.42 111.445 -179.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 70.87 33.71 2.12 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.816 -0.629 . . . . 72.42 110.248 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 62.7 m -154.51 -45.13 0.09 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.753 -0.658 . . . . 54.2 110.683 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -89.08 92.57 9.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.119 -0.492 . . . . 63.5 110.84 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -102.83 154.91 37.18 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.117 -0.492 . . . . 61.23 110.847 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.709 ' HB2' HG21 ' A' ' 166' ' ' VAL . 53.9 Cg_endo -69.73 125.5 12.23 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.522 2.148 . . . . 62.2 112.332 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.432 ' O ' HG23 ' A' ' 166' ' ' VAL . 0.1 OUTLIER -96.44 152.42 18.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 75.12 110.925 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.48 118.98 6.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 74.14 110.859 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 97.36 -16.04 61.28 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.699 -0.763 . . . . 74.22 112.606 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -84.09 140.41 31.83 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.876 0.369 . . . . 74.0 110.969 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.557 HG12 ' C ' ' A' ' 224' ' ' ASP . 8.4 p -71.04 163.45 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 75.25 111.041 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.883 HG22 ' O ' ' A' ' 164' ' ' PHE . 13.0 m -154.91 146.26 13.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.171 -0.468 . . . . 74.02 111.063 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.492 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -128.01 117.76 22.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.718 0.294 . . . . 75.1 110.838 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.465 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 26.1 p -155.27 170.18 22.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.927 0.394 . . . . 64.41 111.047 -179.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.771 ' HB3' HD13 ' A' ' 149' ' ' ILE . 38.2 m95 -106.08 164.6 11.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.949 -0.569 . . . . 74.22 110.308 179.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.504 ' OH ' HD13 ' A' ' 162' ' ' LEU . 12.3 p90 -162.08 137.07 7.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.926 0.394 . . . . 71.41 111.433 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 1.091 HG21 HG11 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -128.06 114.07 16.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.949 -0.568 . . . . 74.21 110.466 179.741 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.614 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.64 144.78 17.44 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.615 -0.802 . . . . 73.51 113.407 -179.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.885 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.95 136.78 18.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.702 0.286 . . . . 64.15 110.367 179.608 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 1.019 HD21 HD12 ' A' ' 208' ' ' ILE . 17.1 mt -68.45 -179.05 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.857 0.36 . . . . 73.2 111.035 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -57.04 -41.78 79.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.025 -0.534 . . . . 75.14 110.862 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.37 0.99 39.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 64.23 111.446 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 91.48 25.83 22.34 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.645 -0.788 . . . . 63.0 112.619 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.95 108.35 16.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.773 0.32 . . . . 75.3 110.835 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.418 HG13 ' O ' ' A' ' 144' ' ' VAL . 11.3 p -68.81 125.34 26.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 65.02 111.138 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.442 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 21.3 p90 -109.96 -22.2 11.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 73.1 111.002 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -162.06 137.9 7.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.401 -0.363 . . . . 75.15 110.836 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.905 HG23 HG23 ' A' ' 136' ' ' THR . 52.3 m -142.8 106.25 4.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 72.05 111.016 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.48 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 13.8 t30 -82.11 -14.81 55.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 71.34 111.226 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.8 HD11 ' OE1' ' A' ' 7' ' ' GLN . 25.4 mm . . . . . 0 C--N 1.332 -0.181 0 CA-C-O 120.822 0.344 . . . . 73.33 111.096 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.855 0.359 . . . . 73.22 111.038 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -145.01 135.29 11.9 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 71.25 110.887 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . 0.408 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 52.6 Cg_exo -54.68 163.49 3.86 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.445 2.097 . . . . 72.1 112.276 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.531 HD23 ' CD1' ' A' ' 164' ' ' PHE . 2.4 tt -84.54 119.41 25.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 72.42 110.595 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.626 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -95.17 121.79 37.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.897 0.379 . . . . 45.53 111.175 -179.93 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.883 ' O ' HG22 ' A' ' 131' ' ' VAL . 8.2 p90 -149.1 140.68 23.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.082 -0.508 . . . . 74.54 110.742 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.566 ' O ' HG22 ' A' ' 168' ' ' VAL . 56.1 mttt -80.68 137.41 36.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.076 0.465 . . . . 73.12 111.118 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.709 HG21 ' HB2' ' A' ' 125' ' ' PRO . 5.8 m -87.36 149.8 3.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.668 -0.696 . . . . 75.24 111.13 -179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.19 22.92 77.53 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.836 -0.697 . . . . 54.14 112.576 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.707 HG23 ' HG2' ' A' ' 170' ' ' LYS . 30.2 m -132.92 40.9 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.896 0.379 . . . . 52.52 111.032 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 49.12 38.85 26.0 Favored Glycine 0 CA--C 1.517 0.218 0 C-N-CA 120.936 -0.649 . . . . 71.14 112.896 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . 0.707 ' HG2' HG23 ' A' ' 168' ' ' VAL . 3.1 mmtt -83.02 -46.5 12.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.901 0.381 . . . . 75.1 110.78 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . 0.588 HG11 ' CE3' ' A' ' 175' ' ' TRP . 0.2 OUTLIER -123.35 -179.06 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.923 -0.581 . . . . 43.13 110.923 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.516 HD11 ' HB2' ' A' ' 175' ' ' TRP . 4.4 pt -57.16 161.37 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.316 -0.402 . . . . 53.04 111.382 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 31.8 ttm180 -69.7 -25.43 63.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 72.14 111.036 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -78.63 -38.55 23.98 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.743 -0.742 . . . . 51.44 112.187 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.648 ' HD1' HD23 ' A' ' 190' ' ' LEU . 3.4 t90 -75.66 -32.36 60.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.902 0.382 . . . . 64.52 111.36 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -72.04 -33.54 68.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.038 -0.528 . . . . 64.54 110.817 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -74.52 -28.98 61.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.115 -0.493 . . . . 63.13 110.83 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -87.98 -50.69 6.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.272 -0.422 . . . . 63.01 111.257 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.477 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 8.4 mt -52.55 -37.12 57.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.078 -0.51 . . . . 74.24 110.885 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 6.9 tp -50.97 -26.17 5.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.097 -0.501 . . . . 74.3 111.418 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.52 3.04 55.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.345 . . . . 73.43 111.624 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 4.7 ttt -79.95 148.99 30.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.752 0.311 . . . . 63.43 110.879 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -118.38 169.68 9.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.427 . . . . 73.13 111.26 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.76 118.52 8.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.859 -0.61 . . . . 73.0 110.659 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 68.01 64.1 3.31 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.687 -0.768 . . . . 43.44 112.476 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . 0.513 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 14.2 tt0 -144.02 147.7 34.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.575 0.226 . . . . 71.3 110.5 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . 0.529 ' HG2' HD13 ' A' ' 116' ' ' LEU . 6.1 tttt -115.94 132.83 56.53 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.066 -0.346 . . . . 74.14 110.066 179.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . 0.822 ' HA ' HD12 ' A' ' 116' ' ' LEU . . . -140.57 170.34 15.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.072 0.463 . . . . 73.25 111.729 -179.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . 0.568 ' HD3' HG23 ' A' ' 215' ' ' THR . 0.2 OUTLIER -123.08 101.39 7.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.653 -0.703 . . . . 72.05 109.892 179.548 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.648 HD23 ' HD1' ' A' ' 175' ' ' TRP . 4.9 mp -99.32 118.17 35.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.044 0.45 . . . . 75.3 112.106 -178.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.87 ' HG2' HG23 ' A' ' 215' ' ' THR . 9.4 mt-10 -110.72 107.71 17.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.666 -0.697 . . . . 62.44 109.574 178.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.454 HG12 ' CE2' ' A' ' 216' ' ' PHE . 3.6 mm -98.29 141.77 15.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.012 0.434 . . . . 74.01 111.639 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.402 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 2.0 mt-10 -81.53 166.66 36.65 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.868 -0.606 . . . . 70.31 110.372 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 21.1 Cg_endo -60.84 -48.72 9.96 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.427 2.084 . . . . 74.53 112.302 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -51.62 -26.32 8.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 54.52 111.442 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.441 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 10.1 m0 -117.61 37.02 4.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.487 -0.324 . . . . 75.44 111.216 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -158.01 -82.9 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.5 -0.318 . . . . 70.42 111.471 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . 0.782 ' CD2' HG21 ' A' ' 208' ' ' ILE . 22.7 m-85 -99.61 -30.36 12.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.855 0.36 . . . . 75.42 111.021 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 103.31 175.46 26.29 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.811 -0.709 . . . . 70.34 112.67 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 7.9 ttmt -57.6 -40.05 78.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.881 0.372 . . . . 74.32 110.848 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -44.6 96.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.059 -0.519 . . . . 70.22 110.607 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 109.14 -154.31 16.53 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.851 -0.69 . . . . 70.32 112.487 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.444 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.6 OUTLIER -139.82 87.3 12.91 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.718 0.294 . . . . 63.13 110.703 179.932 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.11 -22.12 67.64 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.54 2.16 . . . . 74.25 112.471 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.61 -42.11 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.882 0.372 . . . . 72.35 110.866 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -109.79 23.32 14.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.112 -0.494 . . . . 72.12 111.401 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt 56.36 54.4 7.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 61.24 111.067 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 1.019 HD12 HD21 ' A' ' 139' ' ' LEU . 20.2 mm -110.57 111.71 57.0 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 74.33 111.055 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.08 161.05 7.14 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.43 2.086 . . . . 50.32 112.342 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.18 129.35 15.97 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.594 2.196 . . . . 75.24 112.313 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 67.86 37.09 3.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.335 -0.393 . . . . 73.4 110.918 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -91.75 157.45 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.256 -0.429 . . . . 72.21 111.326 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.5 155.97 18.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 62.13 110.507 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.654 HD11 ' CD2' ' A' ' 198' ' ' TYR . 32.4 mt -136.21 109.26 7.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.905 0.383 . . . . 75.54 111.314 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.87 HG23 ' HG2' ' A' ' 191' ' ' GLU . 38.6 m -109.71 137.04 48.09 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.075 -0.511 . . . . 42.24 110.941 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.614 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 13.7 p90 -153.6 178.02 10.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 61.54 111.039 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . 0.457 ' OE2' HD21 ' A' ' 116' ' ' LEU . 10.9 mt-10 -134.07 137.64 44.77 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.926 -0.579 . . . . 70.12 110.541 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.61 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.3 t -120.75 150.97 23.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.131 0.491 . . . . 74.13 111.976 -178.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -136.72 107.58 6.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.612 -0.722 . . . . 75.31 109.953 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.555 HD21 ' CG1' ' A' ' 223' ' ' ILE . 1.0 OUTLIER -70.84 130.57 42.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.433 -0.349 . . . . 70.21 110.913 -179.672 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 25.3 t -107.35 -31.47 2.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.351 -0.386 . . . . 72.21 111.465 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -169.56 160.58 9.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.884 0.373 . . . . 73.1 111.235 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.714 HG23 HG12 ' A' ' 131' ' ' VAL . 44.7 mt -140.56 110.02 3.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.111 -0.495 . . . . 54.24 111.028 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . 0.557 ' C ' HG12 ' A' ' 130' ' ' VAL . 2.4 m-20 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 61.13 110.911 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.979 HG11 HG21 ' A' ' 136' ' ' THR . 39.2 t . . . . . 0 CA--C 1.528 0.114 0 CA-C-O 120.705 0.288 . . . . 71.32 110.965 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.454 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 73.7 Cg_endo -76.48 136.44 17.5 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.654 2.236 . . . . 75.53 112.382 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.528 ' CD ' HD11 ' A' ' 149' ' ' ILE . 2.3 tp-100 -80.66 152.91 28.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.453 . . . . 74.14 110.867 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.7 114.55 1.18 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 72.44 111.173 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -87.75 -38.49 15.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.092 -0.503 . . . . 72.14 110.843 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.595 ' CE2' HD11 ' A' ' 20' ' ' LEU . 1.7 m-90 -112.79 173.69 6.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.955 -0.566 . . . . 63.35 110.708 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -115.09 150.86 35.3 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.063 -0.517 . . . . 75.05 110.69 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.476 HG12 ' HD2' ' A' ' 16' ' ' ARG . 39.2 t -56.04 -32.81 34.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.012 0.434 . . . . 72.14 110.668 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -75.62 -24.68 56.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.803 -0.635 . . . . 74.21 110.969 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.04 -57.46 3.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.85 0.357 . . . . 70.24 110.803 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.515 ' CB ' HG22 ' A' ' 60' ' ' VAL . 0.9 OUTLIER -49.66 -63.41 1.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.28 -0.418 . . . . 70.03 110.952 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.581 ' CG ' HG21 ' A' ' 60' ' ' VAL . 24.4 mtp180 -53.84 -24.38 15.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 61.45 111.194 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.9 177.46 0.15 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.009 0.433 . . . . 74.14 111.255 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.38 17.08 21.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.826 -0.625 . . . . 62.44 111.151 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -106.83 -24.76 11.96 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.527 -0.306 . . . . 64.51 111.263 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.614 HD22 HD11 ' A' ' 25' ' ' ILE . 6.3 tt -93.98 117.8 67.21 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.517 -0.31 . . . . 72.31 111.051 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.42 ' N ' HD23 ' A' ' 20' ' ' LEU . 31.5 Cg_exo -59.07 127.2 23.35 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.419 2.079 . . . . 73.53 112.076 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -24.13 67.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 74.52 111.162 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HA ' HD12 ' A' ' 26' ' ' ILE . 15.4 ptpt -53.91 -39.73 66.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.343 -0.389 . . . . 63.41 111.523 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -73.74 -55.09 6.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.896 0.379 . . . . 70.33 111.015 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.622 ' O ' HD12 ' A' ' 29' ' ' LEU . 28.7 mt -44.71 -33.65 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.862 -0.608 . . . . 64.23 111.379 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.741 HG12 HD21 ' A' ' 59' ' ' LEU . 6.8 mt -76.02 -39.87 37.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 74.3 110.868 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.2 mtpt -72.15 -26.15 61.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.976 -0.556 . . . . 72.2 111.044 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.486 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 33.8 t80 -69.57 -44.63 70.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.05 0.452 . . . . 75.12 110.742 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.691 HD21 ' HA ' ' A' ' 63' ' ' TYR . 2.9 mt -71.7 -24.39 61.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.705 -0.68 . . . . 65.3 110.992 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -76.38 -24.11 54.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.298 -0.41 . . . . 73.24 110.703 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -103.39 -10.19 18.82 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.253 -0.43 . . . . 73.51 111.125 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.486 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 12.1 m170 -116.58 -11.2 11.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.405 -0.361 . . . . 72.54 111.324 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -121.06 165.27 14.15 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.708 -0.758 . . . . 55.2 112.42 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -92.6 150.88 20.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.606 0.241 . . . . 74.25 110.515 179.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.562 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.2 p-10 -48.9 -57.08 7.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.758 0.313 . . . . 61.52 110.941 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.5 m -47.94 -51.97 21.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.018 0.437 . . . . 54.15 110.736 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.493 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 12.5 t80 -52.94 -47.4 68.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.745 -0.662 . . . . 74.22 110.277 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.519 HD22 ' HB3' ' A' ' 43' ' ' LEU . 14.1 mt -65.36 -40.69 93.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.915 -0.584 . . . . 74.42 110.674 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.833 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -49.59 -43.25 46.2 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.227 -0.442 . . . . 54.11 111.063 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -58.01 -29.32 65.2 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.868 -0.606 . . . . 72.13 110.74 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 -112.82 12.02 19.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 55.32 111.102 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 54.44 37.45 27.76 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.866 0.365 . . . . 71.01 110.748 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.679 HD21 HD23 ' A' ' 59' ' ' LEU . 15.3 mt -94.37 -20.95 19.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 74.34 111.895 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.833 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -78.15 155.53 30.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.099 0.476 . . . . 75.25 111.153 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.92 -124.67 6.1 Favored Glycine 0 N--CA 1.451 -0.302 0 CA-C-N 115.638 -0.71 . . . . 64.55 112.43 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.757 ' O ' HG23 ' A' ' 50' ' ' VAL . 8.0 m120 -116.4 119.31 35.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.796 0.331 . . . . 64.41 110.969 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.708 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -45.69 -52.56 2.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.17 -0.468 . . . . 74.03 111.4 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -47.7 -37.09 12.34 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.909 -0.587 . . . . 74.22 110.842 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -85.58 -26.6 26.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.866 -0.606 . . . . 73.21 110.931 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.757 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.5 t -78.59 -26.06 13.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.238 -0.437 . . . . 64.5 111.345 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.33 -25.39 67.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.428 -0.351 . . . . 63.44 111.103 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -95.17 -27.62 15.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 71.31 110.803 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -100.32 33.84 2.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.486 . . . . 74.4 111.012 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -166.76 135.57 2.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 72.21 110.984 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.401 ' H ' ' HB2' ' A' ' 58' ' ' HIS . 14.7 p30 -94.63 177.7 5.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.271 -0.422 . . . . 72.21 110.974 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.558 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -56.62 -57.82 10.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.315 -0.402 . . . . 74.33 110.929 -179.883 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.54 -26.94 64.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.057 -0.519 . . . . 64.04 110.602 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.401 ' HB2' ' H ' ' A' ' 55' ' ' ASN . 0.1 OUTLIER -63.01 -45.69 91.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.023 -0.535 . . . . 75.13 110.793 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.741 HD21 HG12 ' A' ' 26' ' ' ILE . 23.9 mt -73.82 -29.03 61.92 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.714 -0.675 . . . . 75.43 111.202 -179.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.581 HG21 ' CG ' ' A' ' 16' ' ' ARG . 21.1 t -81.08 -43.98 20.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.901 0.382 . . . . 71.32 111.057 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.0 m -59.95 -33.14 71.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.971 -0.559 . . . . 71.43 110.695 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.436 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -84.46 -23.12 30.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 72.52 111.129 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.691 ' HA ' HD21 ' A' ' 29' ' ' LEU . 82.2 t80 -83.78 -23.03 31.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.257 -0.429 . . . . 71.3 110.981 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.502 ' ND2' HG12 ' A' ' 60' ' ' VAL . 42.9 m-20 -81.79 -55.07 4.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 75.23 111.419 -179.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.493 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 4.2 p-80 -61.65 -29.8 70.3 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.153 -0.476 . . . . 71.23 111.296 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.715 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.1 tt -50.2 -40.01 45.88 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.891 0.377 . . . . 64.32 111.194 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -79.03 -38.75 35.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.52 . . . . 74.41 110.695 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.45 -41.15 93.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.941 -0.572 . . . . 75.14 110.768 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.2 p -92.64 -2.61 55.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.936 -0.574 . . . . 60.3 111.462 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.13 38.77 10.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.768 0.318 . . . . 73.22 111.353 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.444 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 45.3 mtt-85 -93.13 43.68 1.13 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.308 -0.406 . . . . 72.14 110.992 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.529 ' HA ' HD21 ' A' ' 66' ' ' LEU . 89.8 m-85 -64.5 178.71 0.7 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 75.43 110.826 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.4 ttmm . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.28 -0.418 . . . . 74.2 110.923 179.988 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.448 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.794 0.331 . . . . 64.23 111.018 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 20.3 p90 -157.83 161.93 38.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.299 -0.409 . . . . 74.52 110.84 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 12.2 m -131.46 103.49 6.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 64.13 111.043 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.66 ' HD2' ' HB1' ' A' ' 178' ' ' ALA . 13.8 tttm -109.59 151.49 26.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 74.24 110.705 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.459 ' O ' HD12 ' A' ' 116' ' ' LEU . 2.1 m -143.31 128.47 18.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 61.43 110.874 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.607 ' O ' HG13 ' A' ' 115' ' ' VAL . 9.2 p -78.55 106.34 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.247 -0.433 . . . . 75.35 111.14 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.459 HD12 ' O ' ' A' ' 114' ' ' SER . 6.8 mp -78.94 -78.01 0.16 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.208 -0.451 . . . . 74.23 110.79 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -86.73 108.07 18.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 73.4 110.753 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.44 121.88 12.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.47 . . . . 70.5 111.049 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -100.03 -159.52 28.41 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.74 -0.743 . . . . 71.35 112.139 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.416 ' O ' ' HB2' ' A' ' 121' ' ' LYS . 0.5 OUTLIER -36.11 -48.87 0.63 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.876 0.369 . . . . 73.02 111.572 -179.479 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 120' ' ' ASP . 20.6 mtpt 67.58 36.9 3.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.845 -0.616 . . . . 54.32 110.349 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -153.91 -44.91 0.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.758 -0.656 . . . . 64.05 110.676 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -88.86 98.47 11.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.14 -0.482 . . . . 74.12 110.853 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -110.61 146.19 33.85 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 65.15 110.842 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.617 ' CB ' HG11 ' A' ' 166' ' ' VAL . 51.7 Cg_exo -54.56 125.55 19.35 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.511 2.141 . . . . 63.44 112.453 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.99 152.22 20.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.109 -0.496 . . . . 74.51 110.8 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -55.22 111.59 0.89 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.243 -0.435 . . . . 62.34 110.881 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 99.8 -10.82 60.79 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.742 -0.742 . . . . 60.11 112.708 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -86.92 134.49 33.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.877 0.37 . . . . 70.31 110.953 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.545 HG22 ' N ' ' A' ' 131' ' ' VAL . 7.1 p -70.65 163.38 3.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 73.11 110.989 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.871 HG22 ' O ' ' A' ' 164' ' ' PHE . 15.7 m -155.05 146.55 13.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.241 -0.436 . . . . 74.24 111.017 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.463 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.89 117.91 22.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.735 0.302 . . . . 72.22 110.891 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.47 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 22.3 p -152.48 166.63 31.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 73.43 111.13 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.57 ' HB3' HD13 ' A' ' 149' ' ' ILE . 19.1 m95 -101.92 164.22 11.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.056 -0.52 . . . . 73.23 110.239 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.401 ' CD1' ' OD1' ' A' ' 148' ' ' ASN . 28.6 p90 -160.38 135.16 7.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.072 0.463 . . . . 75.04 111.867 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.979 HG21 HG11 ' A' ' 5' ' ' VAL . 2.9 m -124.74 109.52 13.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.707 -0.679 . . . . 74.41 110.248 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.67 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.55 144.98 17.55 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.613 -0.803 . . . . 51.4 113.414 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.785 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.79 149.51 29.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.863 0.363 . . . . 33.42 110.825 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.81 HD21 HD12 ' A' ' 208' ' ' ILE . 22.7 mt -88.05 -176.37 5.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 72.21 110.845 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -55.87 -43.58 77.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.356 -0.383 . . . . 73.03 110.899 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.07 -16.78 54.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.945 -0.57 . . . . 73.32 111.161 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 107.31 25.86 5.91 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.724 -0.751 . . . . 32.54 112.589 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.5 m -82.06 112.72 19.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.776 0.322 . . . . 73.42 110.867 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.9 t -66.41 126.78 26.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 62.54 111.171 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.689 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 38.7 p90 -114.36 -28.29 7.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.223 -0.444 . . . . 72.2 111.171 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . 0.421 ' HB2' ' CE1' ' A' ' 145' ' ' PHE . 51.6 m-20 -156.24 111.43 2.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.384 -0.371 . . . . 71.14 110.888 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.633 HG23 HG23 ' A' ' 136' ' ' THR . 61.6 m -142.84 108.88 5.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 25.02 111.096 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.401 ' OD1' ' CD1' ' A' ' 135' ' ' TYR . 20.0 p-10 -102.76 25.6 9.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.428 . . . . 71.03 110.909 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.57 HD13 ' HB3' ' A' ' 134' ' ' TRP . 9.0 mm . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.342 -0.39 . . . . 71.22 110.83 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.1 0 CA-C-O 120.809 0.338 . . . . 74.53 111.097 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 15.4 mttp -146.4 147.7 31.82 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.901 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.95 158.2 57.51 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.6 2.2 . . . . 73.22 112.301 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 1.6 tt -76.43 123.6 26.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 64.13 110.451 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.632 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.3 122.35 42.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.951 0.405 . . . . 64.35 111.411 -179.851 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.871 ' O ' HG22 ' A' ' 131' ' ' VAL . 6.5 p90 -150.98 143.41 24.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 75.04 110.508 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.63 ' O ' HG12 ' A' ' 168' ' ' VAL . 7.3 mtmt -82.25 141.64 32.79 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.079 0.466 . . . . 74.14 111.226 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.617 HG11 ' CB ' ' A' ' 125' ' ' PRO . 33.4 m -87.57 149.15 4.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.779 -0.646 . . . . 63.52 111.167 -179.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.74 24.8 75.43 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.857 -0.687 . . . . 51.52 112.456 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.693 HG22 ' O ' ' A' ' 168' ' ' VAL . 8.4 p -131.69 40.93 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.846 0.355 . . . . 73.35 111.103 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 40.6 34.18 0.68 Allowed Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.996 -0.621 . . . . 51.12 112.942 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.24 -34.26 32.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.053 0.454 . . . . 64.43 110.411 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.8 m -127.34 179.72 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.799 -0.637 . . . . 72.03 110.83 179.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.596 ' CD1' HD13 ' A' ' 192' ' ' ILE . 4.1 pt -58.72 163.84 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.442 -0.344 . . . . 70.04 111.091 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -71.13 -29.21 64.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 65.02 111.197 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.12 -38.09 41.06 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.671 -0.776 . . . . 73.43 112.279 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.734 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.2 t90 -75.22 -32.65 61.21 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.851 0.357 . . . . 75.52 110.996 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -61.94 -43.95 97.79 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 62.53 110.524 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -68.35 -30.82 69.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.903 -0.59 . . . . 73.1 110.751 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.737 ' O ' HG22 ' A' ' 181' ' ' THR . . . -78.0 -61.97 1.83 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.202 -0.454 . . . . 65.23 111.379 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.704 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 6.7 mt -56.07 -31.71 63.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.043 -0.526 . . . . 75.33 111.102 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 35.0 tp -59.49 -32.63 70.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.375 -0.375 . . . . 74.22 111.036 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . 0.737 HG22 ' O ' ' A' ' 178' ' ' ALA . 12.8 t -92.75 -0.65 57.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.327 -0.397 . . . . 74.13 111.479 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.481 ' HE3' ' C ' ' A' ' 218' ' ' VAL . 0.0 OUTLIER -73.26 152.12 41.13 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.698 0.285 . . . . 62.0 110.871 179.905 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.48 162.61 15.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.296 -0.411 . . . . 74.3 111.107 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . 0.635 ' HA ' HD22 ' A' ' 220' ' ' LEU . 1.2 tttm -61.38 119.42 8.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.924 -0.58 . . . . 53.33 111.144 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 76.03 17.79 79.82 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.99 -0.624 . . . . 71.44 113.042 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . 0.538 ' CD ' HG23 ' A' ' 115' ' ' VAL . 1.1 tt0 -96.72 145.99 25.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.873 0.368 . . . . 71.41 111.105 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt -117.33 136.88 52.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 62.2 110.01 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -149.77 176.12 10.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.033 0.444 . . . . 53.55 111.808 -179.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.11 136.27 36.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.691 -0.686 . . . . 63.03 109.572 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.71 HD21 ' CE1' ' A' ' 216' ' ' PHE . 1.4 pt? -140.25 140.42 35.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.141 0.496 . . . . 62.32 112.217 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.739 ' HB3' HG23 ' A' ' 215' ' ' THR . 0.0 OUTLIER -117.74 106.02 12.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.609 -0.723 . . . . 53.14 110.034 179.113 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.596 HD13 ' CD1' ' A' ' 172' ' ' ILE . 4.2 mt -96.52 148.36 5.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.999 0.428 . . . . 60.12 111.582 -179.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.425 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.6 OUTLIER -81.69 167.51 30.76 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.765 -0.652 . . . . 65.4 110.477 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . 0.425 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 18.1 Cg_endo -60.1 -39.84 66.05 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.462 2.108 . . . . 64.13 112.222 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.12 -22.72 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.172 -0.467 . . . . 65.02 111.449 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.448 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 8.9 m0 -118.03 37.01 4.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.687 0.28 . . . . 72.32 111.399 -179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -155.43 -84.56 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.414 -0.357 . . . . 74.01 111.362 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . 0.459 ' HD2' HG21 ' A' ' 208' ' ' ILE . 41.4 m-85 -106.0 -27.95 10.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.905 0.384 . . . . 75.21 110.828 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 107.28 178.9 22.55 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.846 -0.692 . . . . 71.33 112.836 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -59.61 -36.22 75.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.826 0.346 . . . . 74.44 110.892 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.6 -50.03 75.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 64.12 110.658 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.3 -153.38 17.25 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.86 -0.686 . . . . 70.05 112.595 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.446 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 2.0 tm0? -152.15 84.26 4.9 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.837 0.351 . . . . 72.51 110.515 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -49.99 -44.43 37.34 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.762 2.308 . . . . 72.31 112.783 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.72 -42.12 71.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 65.24 111.012 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.689 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -96.43 27.37 3.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.031 -0.531 . . . . 61.24 111.29 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt 49.19 30.65 3.15 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.889 0.376 . . . . 61.33 111.057 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.81 HD12 HD21 ' A' ' 139' ' ' LEU . 20.8 mm -94.8 111.75 55.49 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.098 -0.501 . . . . 73.14 111.188 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . 0.561 ' HG2' ' HB2' ' A' ' 212' ' ' ALA . 55.9 Cg_endo -69.95 171.04 15.4 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.405 2.07 . . . . 54.14 112.201 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.79 120.95 8.33 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.512 2.141 . . . . 74.24 112.228 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . 0.405 ' HA ' ' HG3' ' A' ' 194' ' ' PRO . 49.2 m-80 63.4 70.38 0.53 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.173 -0.467 . . . . 72.24 110.859 -179.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . 0.561 ' HB2' ' HG2' ' A' ' 209' ' ' PRO . . . -122.42 154.7 37.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.183 -0.462 . . . . 72.42 111.336 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . 0.723 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.0 OUTLIER -90.42 149.43 22.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.019 -0.537 . . . . 71.23 110.448 179.646 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.723 HD23 ' O ' ' A' ' 213' ' ' LYS . 9.0 mt -131.5 109.72 10.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.857 0.361 . . . . 75.22 111.313 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.739 HG23 ' HB3' ' A' ' 191' ' ' GLU . 1.4 m -110.11 140.49 44.13 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.057 -0.519 . . . . 74.21 110.779 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.71 ' CE1' HD21 ' A' ' 190' ' ' LEU . 23.2 p90 -155.92 -179.67 8.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.077 0.465 . . . . 75.14 111.374 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . 0.417 ' HB3' ' HB2' ' A' ' 7' ' ' GLN . 4.1 mt-10 -132.89 136.61 46.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.72 -0.673 . . . . 73.15 110.256 179.41 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.734 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.8 t -120.99 150.31 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.018 0.437 . . . . 74.14 111.792 -178.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -136.23 108.51 7.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.809 -0.632 . . . . 71.24 110.27 179.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.696 HD21 HG13 ' A' ' 223' ' ' ILE . 2.2 tt -70.05 129.55 39.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.332 -0.394 . . . . 64.1 110.91 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 29.6 t -105.99 -31.7 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.169 -0.469 . . . . 74.25 111.483 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . 0.414 ' N ' HD23 ' A' ' 220' ' ' LEU . 5.4 t70 -170.3 161.14 8.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.93 0.395 . . . . 74.31 111.219 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.821 HG23 HG12 ' A' ' 131' ' ' VAL . 38.4 mt -140.85 110.21 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.053 -0.521 . . . . 65.31 111.003 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . 0.525 ' C ' HG12 ' A' ' 130' ' ' VAL . 2.7 m-20 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 63.33 110.875 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.934 HG11 HG21 ' A' ' 136' ' ' THR . 31.4 t . . . . . 0 CA--C 1.529 0.159 0 CA-C-O 120.577 0.227 . . . . 42.24 110.94 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -82.9 153.64 14.86 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.637 2.224 . . . . 55.52 112.607 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.53 ' NE2' HD11 ' A' ' 149' ' ' ILE . 3.0 tp60 -86.38 152.84 22.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 65.02 110.825 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.75 127.03 28.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 54.45 111.134 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -95.58 -31.43 13.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 54.31 110.892 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.455 ' CD1' HD11 ' A' ' 20' ' ' LEU . 3.0 m-90 -114.23 173.62 6.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.046 -0.525 . . . . 74.12 110.732 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 m -115.55 152.3 33.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.044 -0.526 . . . . 53.22 110.708 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.427 ' CG1' ' HD2' ' A' ' 16' ' ' ARG . 49.1 t -56.24 -34.01 38.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 62.1 110.691 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -73.34 -25.28 60.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.968 -0.56 . . . . 74.44 111.147 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -82.01 -56.55 3.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.821 0.343 . . . . 54.15 110.942 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.687 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.3 mt -49.49 -64.64 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 73.41 111.17 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.502 ' HG3' HG11 ' A' ' 60' ' ' VAL . 34.6 mtp85 -54.11 -25.0 19.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 64.03 111.229 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.96 176.62 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.0 0.429 . . . . 71.53 111.293 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -110.34 17.01 21.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.878 -0.601 . . . . 74.24 111.175 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -112.7 -23.45 10.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.554 -0.294 . . . . 73.32 111.222 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.717 HD22 HD11 ' A' ' 25' ' ' ILE . 10.2 tt -90.07 114.03 59.38 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.509 -0.314 . . . . 71.31 110.99 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -57.92 125.3 18.18 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.493 2.129 . . . . 63.11 112.303 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -24.19 67.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 71.23 111.245 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.499 ' HA ' HD12 ' A' ' 26' ' ' ILE . 29.5 mmtt -52.69 -35.16 54.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.397 . . . . 73.45 111.37 -179.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.91 -56.59 4.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.283 -0.417 . . . . 73.15 111.109 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.717 HD11 HD22 ' A' ' 20' ' ' LEU . 40.4 mt -44.79 -32.86 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.896 -0.593 . . . . 72.53 111.474 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.699 HG12 HD21 ' A' ' 59' ' ' LEU . 9.4 mt -75.19 -41.72 44.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.964 0.412 . . . . 45.12 110.907 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -71.55 -25.02 62.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.874 -0.603 . . . . 74.42 111.116 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -70.03 -44.71 68.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.042 0.448 . . . . 62.12 110.761 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.782 HD23 HD12 ' A' ' 66' ' ' LEU . 7.7 mt -72.17 -21.42 61.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.728 -0.669 . . . . 71.21 111.101 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -83.87 -25.78 29.98 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.356 -0.384 . . . . 72.25 111.066 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -100.97 -1.01 35.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.422 -0.354 . . . . 70.52 111.512 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.422 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.9 m-70 -131.95 -6.47 3.53 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.697 0.258 . . . . 61.1 111.697 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.87 164.43 13.07 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.735 -0.745 . . . . 22.0 112.357 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 54.5 p -91.53 147.94 22.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.584 0.23 . . . . 60.33 110.553 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.727 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -48.16 -57.03 6.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.798 0.332 . . . . 54.4 110.991 -179.77 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.9 m -48.67 -50.03 34.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.083 0.468 . . . . 74.51 110.574 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.479 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 36.5 t80 -53.6 -48.76 68.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.695 -0.684 . . . . 52.55 110.404 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.409 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 15.8 mt -65.01 -40.46 94.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.936 -0.575 . . . . 63.23 110.719 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.744 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.17 -47.68 23.89 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.046 0.45 . . . . 75.53 111.098 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -58.09 -26.14 62.2 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.72 -0.673 . . . . 64.4 110.842 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.445 ' O ' ' CG ' ' A' ' 42' ' ' LYS . 52.5 m-70 -112.4 10.57 19.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.265 -0.425 . . . . 74.1 111.239 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.445 ' CG ' ' O ' ' A' ' 41' ' ' HIS . 6.0 ptpt 49.18 35.28 7.08 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.954 0.406 . . . . 63.23 110.995 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.747 HD13 HD13 ' A' ' 29' ' ' LEU . 19.0 mt -93.51 -20.44 20.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.959 -0.564 . . . . 72.23 111.574 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.744 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -79.32 159.26 27.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.026 0.441 . . . . 71.23 111.147 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.56 -120.53 4.97 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 115.775 -0.648 . . . . 60.0 112.482 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.764 ' O ' HG23 ' A' ' 50' ' ' VAL . 46.6 m-80 -116.37 116.12 27.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.826 0.346 . . . . 74.21 110.878 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.662 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.83 -55.57 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.164 -0.471 . . . . 73.23 111.407 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.3 ptpt -46.95 -36.85 8.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.855 -0.611 . . . . 63.41 110.988 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -85.76 -25.47 26.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.939 -0.573 . . . . 72.22 111.067 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.764 HG23 ' O ' ' A' ' 46' ' ' ASN . 28.3 t -83.09 -25.92 7.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.365 -0.379 . . . . 74.01 111.403 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.11 -16.29 63.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.426 -0.352 . . . . 34.4 111.474 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.32 -34.3 12.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.808 0.337 . . . . 34.41 110.895 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.586 HG22 ' HA ' ' A' ' 50' ' ' VAL . 7.4 t -86.95 -30.14 21.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.199 -0.455 . . . . 51.23 111.038 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.13 126.64 40.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 33.1 111.142 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -82.0 177.04 9.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 65.01 110.683 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.574 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -58.84 -58.24 9.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.91 0.386 . . . . 75.44 110.541 179.912 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.17 -27.32 68.99 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.055 -0.52 . . . . 64.04 110.582 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.59 -40.61 95.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.067 -0.515 . . . . 70.41 110.399 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.699 HD21 HG12 ' A' ' 26' ' ' ILE . 20.3 mt -76.59 -31.12 57.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.743 -0.662 . . . . 73.33 110.936 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.687 HG22 ' HB3' ' A' ' 15' ' ' LEU . 21.7 t -77.75 -42.73 29.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.995 0.426 . . . . 73.1 110.68 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 53.6 m -60.51 -35.46 76.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.885 -0.598 . . . . 74.31 110.398 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.448 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -79.54 -22.06 44.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.981 -0.554 . . . . 61.4 110.823 179.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.682 ' HA ' HD21 ' A' ' 29' ' ' LEU . 20.4 t80 -83.69 -22.94 31.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.066 -0.516 . . . . 74.43 110.837 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.522 ' ND2' HG12 ' A' ' 60' ' ' VAL . 43.6 m-80 -85.73 -53.74 4.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.17 0.509 . . . . 73.4 110.809 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.479 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 1.6 p-80 -59.97 -24.14 64.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.86 -0.609 . . . . 72.02 110.788 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.782 HD12 HD23 ' A' ' 29' ' ' LEU . 0.6 OUTLIER -44.93 -45.99 10.74 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.016 0.436 . . . . 73.01 110.521 179.641 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -79.28 -38.61 34.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.566 -0.743 . . . . 74.31 109.929 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -64.18 -16.24 61.52 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.739 -0.664 . . . . 53.03 111.246 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.86 -11.99 10.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.349 -0.387 . . . . 71.22 111.269 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 51.91 34.63 13.94 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.832 0.348 . . . . 74.35 110.987 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.455 ' CB ' ' CD1' ' A' ' 37' ' ' PHE . 91.6 mtt180 -98.4 46.45 1.0 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 72.43 110.91 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.599 ' CZ ' HD22 ' A' ' 66' ' ' LEU . 82.1 m-85 -71.15 -178.59 2.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.077 -0.511 . . . . 75.54 110.784 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.8 tttp . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.303 -0.408 . . . . 72.4 110.824 179.922 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.2 mttt . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.864 0.364 . . . . 74.32 110.949 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -167.29 151.68 6.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 71.14 110.864 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 26.0 m -113.74 129.94 56.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 60.11 110.296 179.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.4 ' CG ' ' HB3' ' A' ' 190' ' ' LEU . 0.1 OUTLIER -129.93 144.14 51.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.973 0.416 . . . . 63.13 111.374 -179.546 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.428 ' O ' HD12 ' A' ' 116' ' ' LEU . 0.4 OUTLIER -139.94 120.86 14.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.919 -0.582 . . . . 61.25 110.461 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.604 ' O ' HG13 ' A' ' 115' ' ' VAL . 10.0 p -76.41 106.26 6.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.917 0.389 . . . . 41.32 111.191 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.455 HD11 ' HB3' ' A' ' 189' ' ' ARG . 6.6 mp -75.74 -75.38 0.18 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 70.41 110.87 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -96.97 107.94 20.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.154 -0.476 . . . . 62.23 110.9 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -58.68 126.29 27.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.166 -0.47 . . . . 73.32 110.937 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -86.26 -174.29 49.49 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.654 -0.784 . . . . 35.33 112.224 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -40.46 -40.95 1.32 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.828 0.347 . . . . 73.23 111.544 -179.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.8 tttp 73.4 43.15 0.38 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.461 . . . . 74.53 110.595 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.0 m -157.3 -45.41 0.07 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.899 -0.592 . . . . 73.31 110.55 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.14 97.55 10.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.07 -0.514 . . . . 71.01 110.692 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -111.11 156.12 41.47 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.078 -0.51 . . . . 74.31 110.834 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.776 ' HB2' HG21 ' A' ' 166' ' ' VAL . 46.9 Cg_endo -68.61 125.6 12.96 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.514 2.143 . . . . 71.14 112.342 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.98 152.16 20.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 73.24 110.937 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -58.84 116.1 3.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 72.51 110.9 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 105.05 -21.92 34.61 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.705 -0.759 . . . . 73.42 112.669 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.3 138.99 31.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.845 0.355 . . . . 74.41 110.828 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.701 HG12 ' HG3' ' A' ' 165' ' ' LYS . 24.4 m -69.59 171.95 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 72.12 111.235 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.896 HG22 ' O ' ' A' ' 164' ' ' PHE . 16.4 m -156.87 145.39 11.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.71 -0.677 . . . . 65.54 110.66 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.439 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.72 117.61 22.25 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.986 -0.285 . . . . 73.34 110.72 179.705 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.657 ' HB3' HD22 ' A' ' 220' ' ' LEU . 31.3 p -153.67 171.44 18.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.004 0.43 . . . . 70.03 111.15 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.51 ' HE1' HG21 ' A' ' 221' ' ' VAL . 10.0 m95 -107.67 161.85 14.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.8 -0.637 . . . . 75.33 110.107 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.489 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 45.1 p90 -161.74 137.19 7.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.07 0.462 . . . . 75.34 111.917 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.934 HG21 HG11 ' A' ' 5' ' ' VAL . 5.4 m -126.72 112.38 15.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.661 -0.699 . . . . 73.35 110.646 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.612 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.67 142.57 16.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.603 -0.808 . . . . 61.45 112.976 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.605 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -147.58 143.87 28.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.8 0.333 . . . . 71.42 110.762 179.79 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.456 HD23 ' HA ' ' A' ' 139' ' ' LEU . 14.2 mt -83.22 -177.63 6.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 73.44 110.977 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -59.29 -43.22 92.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 72.04 110.906 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.81 -7.78 54.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.045 -0.525 . . . . 74.24 111.327 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . 0.442 ' C ' HG22 ' A' ' 138' ' ' THR . . . 92.42 24.12 24.82 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.695 -0.764 . . . . 75.12 112.619 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.41 113.24 25.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.345 . . . . 52.23 110.777 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 137' ' ' GLY . 8.3 p -63.64 130.95 29.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 55.41 111.162 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.432 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 36.2 p90 -108.95 -28.2 9.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.001 -0.545 . . . . 73.12 110.842 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -168.19 122.23 0.92 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.176 -0.465 . . . . 72.11 110.768 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.549 ' OG1' HG23 ' A' ' 136' ' ' THR . 10.4 t -142.87 124.31 14.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.358 -0.383 . . . . 63.12 111.192 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.489 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 29.9 t30 -91.86 40.85 1.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.082 -0.508 . . . . 60.54 110.804 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.53 HD11 ' NE2' ' A' ' 7' ' ' GLN . 6.7 mm . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.123 -0.489 . . . . 60.44 110.928 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.769 0.319 . . . . 65.13 111.097 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -146.38 134.38 10.6 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.255 -0.43 . . . . 73.23 110.837 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . 0.404 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 49.6 Cg_exo -55.37 156.4 17.41 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.446 2.097 . . . . 61.43 112.33 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.535 HD23 ' C ' ' A' ' 162' ' ' LEU . 4.0 tt -74.67 122.96 24.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 74.42 110.429 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.661 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -100.26 121.2 41.09 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.03 0.443 . . . . 74.21 111.48 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.896 ' O ' HG22 ' A' ' 131' ' ' VAL . 7.3 p90 -149.71 140.97 23.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.88 -0.6 . . . . 75.22 110.571 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.701 ' HG3' HG12 ' A' ' 130' ' ' VAL . 72.3 mttt -77.48 136.7 38.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.038 0.447 . . . . 64.44 111.111 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.776 HG21 ' HB2' ' A' ' 125' ' ' PRO . 35.1 m -87.65 149.31 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.822 -0.627 . . . . 54.01 111.084 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.87 22.83 78.34 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.786 -0.721 . . . . 75.53 112.565 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.671 HG23 ' HG2' ' A' ' 170' ' ' LYS . 28.9 m -131.06 42.18 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.88 0.371 . . . . 73.43 111.044 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.25 38.57 6.6 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 121.137 -0.554 . . . . 55.44 113.062 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . 0.671 ' HG2' HG23 ' A' ' 168' ' ' VAL . 0.6 OUTLIER -84.34 -47.03 11.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.933 0.397 . . . . 72.0 110.852 179.928 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.9 m -116.91 -179.94 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.943 -0.571 . . . . 62.22 110.913 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.554 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.88 161.44 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.414 -0.357 . . . . 74.42 111.297 -179.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 15.8 ttt85 -69.57 -26.68 64.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.195 -0.457 . . . . 73.13 110.998 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.11 -37.86 36.51 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.772 -0.727 . . . . 64.43 112.029 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.554 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 1.8 t90 -77.46 -32.9 54.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.024 0.44 . . . . 74.33 111.056 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . 0.639 ' O ' HD13 ' A' ' 180' ' ' LEU . 1.4 m-20 -65.63 -35.47 80.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.802 -0.635 . . . . 73.43 110.479 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -75.97 -29.17 58.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 71.01 110.634 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.582 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -81.92 -54.44 5.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 64.41 111.125 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.574 HD21 HG21 ' A' ' 218' ' ' VAL . 14.5 mt -62.26 -18.92 62.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.883 -0.599 . . . . 75.54 111.186 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.639 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.8 tp -56.46 -23.91 42.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.344 -0.389 . . . . 65.44 111.452 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 16.5 p -112.94 18.13 18.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.596 -0.275 . . . . 71.15 111.585 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.437 ' HG3' HD22 ' A' ' 179' ' ' LEU . 7.4 mmm -77.06 95.18 4.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.831 0.348 . . . . 63.23 111.123 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.3 168.18 7.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 73.12 111.064 -179.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -62.81 113.23 2.92 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.873 -0.603 . . . . 62.31 110.949 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 84.98 0.96 88.99 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 120.854 -0.689 . . . . 54.22 112.91 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.58 137.94 44.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.923 0.392 . . . . 74.44 111.503 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.75 137.41 53.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.976 -0.556 . . . . 71.44 109.766 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -141.83 168.59 19.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.259 0.552 . . . . 70.12 112.132 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . 0.455 ' HB3' HD11 ' A' ' 116' ' ' LEU . 1.4 tmt_? -137.78 101.01 4.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.391 -0.822 . . . . 63.15 109.766 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.582 HD13 ' CB ' ' A' ' 178' ' ' ALA . 0.8 OUTLIER -123.66 149.48 45.39 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.067 0.461 . . . . 71.1 112.011 -178.912 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.638 ' HB3' HG23 ' A' ' 215' ' ' THR . 0.2 OUTLIER -119.37 117.1 27.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.605 -0.725 . . . . 71.12 110.247 179.337 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.633 HD12 ' N ' ' A' ' 192' ' ' ILE . 3.3 mp -98.33 137.85 24.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.969 0.414 . . . . 71.03 111.516 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.41 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.4 mt-10 -71.36 167.56 28.94 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.866 -0.607 . . . . 75.4 110.499 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . 0.41 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 20.8 Cg_endo -60.94 -41.65 43.21 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.391 2.061 . . . . 65.21 112.261 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -53.11 -26.82 17.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 65.23 111.405 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . . . . . . . . . 17.8 m0 -116.1 37.01 3.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.494 -0.321 . . . . 65.23 111.178 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -157.84 -82.3 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.348 -0.387 . . . . 64.24 111.641 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . 0.586 ' CE2' HD13 ' A' ' 208' ' ' ILE . 14.2 m-85 -106.25 -32.9 7.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.907 0.384 . . . . 75.23 110.949 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 106.49 172.55 23.02 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.84 -0.695 . . . . 72.45 112.715 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 33.7 mtmt -61.59 -30.41 70.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.832 0.348 . . . . 73.14 110.902 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -56.16 -52.25 65.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 72.33 110.8 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 109.25 158.33 18.26 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.818 -0.706 . . . . 73.11 112.444 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.747 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.9 OUTLIER -104.76 84.84 1.04 Allowed Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 120.771 0.32 . . . . 64.11 110.758 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.01 -20.15 57.43 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.591 2.194 . . . . 52.4 112.412 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -58.56 -41.89 86.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.368 -0.378 . . . . 45.53 110.891 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.5 28.38 8.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.102 -0.499 . . . . 75.33 111.26 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 7.9 tttt 58.43 54.42 5.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.937 0.399 . . . . 70.24 110.95 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.747 HD12 ' HB3' ' A' ' 203' ' ' GLN . 33.9 mt -115.69 111.77 43.41 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 72.45 111.086 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.1 169.26 2.92 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.568 2.179 . . . . 71.11 112.398 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.27 128.01 12.49 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.636 2.224 . . . . 74.42 112.24 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 65.81 74.22 0.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.31 -0.404 . . . . 51.22 110.758 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.57 153.5 43.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.434 . . . . 74.01 111.365 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.12 139.16 30.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.011 -0.54 . . . . 75.22 110.367 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.447 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 5.8 mt -120.45 109.48 15.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.922 0.391 . . . . 73.1 111.441 -179.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.638 HG23 ' HB3' ' A' ' 191' ' ' GLU . 2.6 m -107.48 141.1 39.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.018 -0.537 . . . . 75.32 110.662 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.612 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 5.8 p90 -159.64 -177.7 6.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 73.43 111.177 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -138.71 141.86 38.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.899 -0.591 . . . . 72.33 110.552 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.574 HG21 HD21 ' A' ' 179' ' ' LEU . 23.5 t -121.55 152.43 25.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 70.42 112.01 -178.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -135.5 106.0 6.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.707 -0.679 . . . . 75.02 110.356 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.657 HD22 ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.67 126.79 30.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.362 -0.381 . . . . 73.43 110.658 -179.774 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.51 HG21 ' HE1' ' A' ' 134' ' ' TRP . 21.2 t -108.06 -30.25 2.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.263 -0.426 . . . . 71.13 111.654 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -169.96 160.05 8.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.915 0.388 . . . . 63.53 111.183 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.647 HG23 HG12 ' A' ' 131' ' ' VAL . 3.5 mp -141.85 111.27 2.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.971 -0.559 . . . . 61.21 110.955 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.327 -0.397 . . . . 64.44 110.958 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 1.021 HG11 HG21 ' A' ' 136' ' ' THR . 43.8 t . . . . . 0 CA--C 1.528 0.121 0 CA-C-O 120.62 0.248 . . . . 51.33 110.966 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.434 ' HG3' ' CG ' ' A' ' 32' ' ' HIS . 72.4 Cg_endo -77.62 136.99 15.89 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.638 2.226 . . . . 74.44 112.435 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 19.6 mm-40 -80.25 155.52 27.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 71.14 110.902 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.09 112.81 0.78 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.137 -0.483 . . . . 64.13 111.221 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.449 ' HB2' ' HE2' ' A' ' 187' ' ' LYS . . . -90.44 -14.78 32.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 71.43 111.414 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.595 ' CE2' HD11 ' A' ' 20' ' ' LEU . 1.3 m-90 -137.98 173.79 11.26 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.967 0.413 . . . . 74.3 110.814 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.2 m -115.43 149.83 37.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.988 -0.551 . . . . 63.43 110.713 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.591 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.9 t -56.09 -31.33 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.926 0.393 . . . . 73.12 110.712 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -76.02 -25.96 56.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.871 -0.604 . . . . 70.11 111.004 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -82.11 -57.92 3.18 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.834 0.349 . . . . 54.12 110.813 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.644 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.3 mt -49.57 -63.09 1.21 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.222 -0.445 . . . . 73.2 110.948 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.591 ' HD2' HG12 ' A' ' 12' ' ' VAL . 25.4 mtt180 -53.99 -23.79 14.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.071 -0.513 . . . . 74.51 111.243 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.18 176.76 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.964 0.412 . . . . 62.43 111.121 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -110.34 16.8 21.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.95 -0.568 . . . . 74.31 111.158 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.41 -26.09 12.09 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.512 -0.313 . . . . 71.31 111.144 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.699 HD22 HD11 ' A' ' 25' ' ' ILE . 6.3 tt -91.97 111.55 50.45 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.39 -0.368 . . . . 64.53 111.016 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.406 ' O ' HD23 ' A' ' 20' ' ' LEU . 48.2 Cg_exo -55.88 130.01 38.04 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.378 2.052 . . . . 51.14 112.184 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.42 ' O ' HD12 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -62.31 -24.09 67.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 75.23 111.127 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.5 mttt -49.78 -43.19 48.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.31 -0.404 . . . . 71.2 111.588 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -73.86 -54.79 7.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.936 0.398 . . . . 75.12 111.07 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.699 HD11 HD22 ' A' ' 20' ' ' LEU . 25.7 mt -45.36 -33.86 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.846 -0.615 . . . . 71.43 111.443 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.694 HG12 HD21 ' A' ' 59' ' ' LEU . 6.7 mt -76.79 -39.85 31.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.284 -0.416 . . . . 73.24 110.995 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.1 mttt -72.86 -25.61 61.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.036 -0.529 . . . . 61.15 111.009 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -69.74 -45.78 67.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.121 0.486 . . . . 74.14 110.719 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.723 HD21 ' HA ' ' A' ' 63' ' ' TYR . 2.6 mt -70.17 -25.58 63.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.608 -0.724 . . . . 62.14 111.115 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -74.38 -26.74 60.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.355 -0.384 . . . . 64.2 110.893 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.416 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 8.6 pt-20 -90.81 -39.05 12.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.346 -0.388 . . . . 73.23 110.706 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.434 ' CG ' ' HG3' ' A' ' 6' ' ' PRO . 35.8 m170 -98.54 16.63 21.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 64.1 110.964 179.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.61 153.32 23.02 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.829 -0.7 . . . . 62.42 112.571 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.57 154.47 19.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.651 0.263 . . . . 53.33 110.515 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.67 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.1 OUTLIER -49.14 -56.97 7.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.76 0.315 . . . . 74.42 111.1 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -48.18 -50.23 29.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.033 0.444 . . . . 54.42 110.896 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.545 ' CZ ' HD12 ' A' ' 66' ' ' LEU . 13.4 t80 -54.04 -47.73 71.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.795 -0.639 . . . . 72.11 110.493 179.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.441 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 13.3 mt -66.02 -41.39 91.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.062 -0.517 . . . . 65.01 110.777 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.827 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -48.07 -42.04 27.67 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.076 0.465 . . . . 73.4 110.827 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -49.55 -50.11 43.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.621 -0.718 . . . . 74.4 110.926 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -101.49 15.3 29.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.076 -0.511 . . . . 63.21 111.291 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 36.1 mttt 54.98 39.92 31.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.884 0.373 . . . . 73.53 111.05 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 43' ' ' LEU . 17.0 mt -89.53 -22.18 22.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 72.41 111.487 -179.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.827 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.42 156.01 28.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.106 0.479 . . . . 74.23 111.171 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.72 -120.98 4.87 Favored Glycine 0 N--CA 1.451 -0.301 0 CA-C-N 115.641 -0.709 . . . . 74.12 112.379 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.897 ' O ' HG23 ' A' ' 50' ' ' VAL . 5.2 m120 -116.39 115.2 25.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.771 0.32 . . . . 53.42 110.948 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.531 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -45.18 -58.37 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.186 -0.461 . . . . 62.42 111.397 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 mmtt -45.57 -36.96 5.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.782 -0.644 . . . . 74.35 111.049 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -85.77 -26.54 25.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.939 -0.573 . . . . 71.53 110.993 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 46' ' ' ASN . 19.3 t -80.83 -26.03 10.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 71.12 111.417 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.64 -15.7 63.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.364 -0.38 . . . . 62.31 111.394 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.3 mtpt -95.17 -35.16 11.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.411 -0.359 . . . . 63.44 110.931 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 m -86.03 -22.42 27.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.173 -0.467 . . . . 61.44 111.318 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -107.95 136.76 47.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.467 -0.333 . . . . 35.33 111.19 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -93.27 -178.02 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 65.3 110.768 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.546 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -59.71 -58.1 10.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.825 0.345 . . . . 72.31 110.981 -179.758 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.32 -27.3 65.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.119 -0.491 . . . . 72.35 110.67 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -45.48 93.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.007 -0.542 . . . . 71.14 110.702 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.694 HD21 HG12 ' A' ' 26' ' ' ILE . 23.6 mt -73.31 -30.49 63.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.625 -0.716 . . . . 70.55 111.415 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.644 HG22 ' HB3' ' A' ' 15' ' ' LEU . 16.0 t -80.51 -43.67 21.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.989 0.424 . . . . 71.3 110.853 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.1 m -58.44 -35.87 72.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.881 -0.6 . . . . 71.43 110.583 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.71 -21.84 34.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.084 -0.507 . . . . 71.24 111.031 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.723 ' HA ' HD21 ' A' ' 29' ' ' LEU . 49.3 t80 -83.28 -22.96 32.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.298 -0.41 . . . . 73.22 111.162 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.476 ' ND2' HG12 ' A' ' 60' ' ' VAL . 19.8 m-80 -83.07 -54.03 5.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.885 0.374 . . . . 74.13 111.43 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.433 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 4.4 p-80 -61.16 -34.08 74.45 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.495 . . . . 63.03 111.283 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.661 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.2 tt -46.42 -40.47 12.24 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.898 0.38 . . . . 73.11 111.201 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -78.98 -36.09 41.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.009 -0.541 . . . . 74.42 110.691 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.536 ' HG2' HG23 ' A' ' 69' ' ' THR . 2.2 pt-20 -67.25 -39.85 86.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.058 -0.519 . . . . 72.24 110.873 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.536 HG23 ' HG2' ' A' ' 68' ' ' GLU . 71.5 p -94.87 -3.1 49.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.025 -0.534 . . . . 33.34 111.434 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 48.96 39.66 15.1 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.757 0.313 . . . . 61.45 111.38 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -93.52 43.66 1.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.384 -0.371 . . . . 73.34 111.034 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.447 ' HA ' HD21 ' A' ' 66' ' ' LEU . 88.5 m-85 -66.26 177.09 1.54 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.317 -0.401 . . . . 61.4 110.82 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.2 tttt . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.262 -0.426 . . . . 74.53 110.985 179.922 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.444 ' HB3' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 120.82 0.343 . . . . 70.02 110.687 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -166.53 150.52 7.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 74.14 110.858 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . 0.428 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 77.0 m -112.23 133.02 54.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.126 -0.488 . . . . 75.32 110.346 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.402 ' CE ' HG22 ' A' ' 115' ' ' VAL . 1.0 OUTLIER -130.88 148.32 52.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.953 0.406 . . . . 64.11 111.33 -179.607 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -149.6 121.75 8.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.934 -0.576 . . . . 53.21 110.742 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.402 HG22 ' CE ' ' A' ' 113' ' ' LYS . 21.5 t -78.86 110.24 14.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.326 -0.397 . . . . 75.22 111.224 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.526 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -81.69 -46.62 14.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 64.03 110.926 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -124.32 108.12 11.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.438 . . . . 74.34 111.054 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.6 ttpm? -59.57 141.89 53.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 74.41 110.865 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.504 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -112.86 -156.11 12.35 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.738 -0.744 . . . . 71.21 112.605 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -36.05 -51.72 0.74 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.96 0.409 . . . . 64.52 111.527 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 69.03 33.82 3.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.926 -0.579 . . . . 63.1 110.307 -179.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 54.8 m -152.4 -44.61 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.76 -0.655 . . . . 60.43 110.698 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -88.94 91.13 8.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.481 . . . . 62.13 110.732 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -99.5 152.72 37.9 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 74.15 110.826 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.57 ' HB2' HG21 ' A' ' 166' ' ' VAL . 61.2 Cg_endo -72.96 125.5 10.46 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.551 2.167 . . . . 72.24 112.495 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.4 mmtm -96.36 154.13 17.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.982 -0.554 . . . . 63.23 110.865 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.0 tptm -56.75 119.67 6.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.24 -0.437 . . . . 52.44 110.795 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 100.24 -22.72 38.81 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.626 -0.797 . . . . 72.44 112.366 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.708 ' O ' HG22 ' A' ' 166' ' ' VAL . 5.0 m-20 -81.54 137.63 35.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.745 0.307 . . . . 70.24 110.69 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.57 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 15.6 m -75.09 175.41 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.198 0.523 . . . . 65.43 111.767 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.685 HG12 HG23 ' A' ' 223' ' ' ILE . 22.3 m -157.75 147.0 9.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.342 -0.845 . . . . 74.13 110.557 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.453 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -125.21 117.27 23.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.701 0.286 . . . . 74.41 110.633 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.456 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 32.1 p -154.2 167.25 30.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.87 0.367 . . . . 74.33 111.156 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.602 ' HB3' HD11 ' A' ' 149' ' ' ILE . 62.6 m95 -99.66 160.6 14.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.972 -0.558 . . . . 64.25 110.065 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 33.4 p90 -158.76 135.18 9.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.065 0.459 . . . . 75.23 111.584 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 1.021 HG21 HG11 ' A' ' 5' ' ' VAL . 54.3 m -126.74 111.59 14.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.658 -0.701 . . . . 64.24 110.417 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.577 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.78 142.9 16.35 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.604 -0.808 . . . . 75.31 113.07 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.69 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.1 OUTLIER -149.34 138.95 21.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.761 0.315 . . . . 73.1 110.799 179.764 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.831 HD11 HG12 ' A' ' 208' ' ' ILE . 32.6 mt -72.81 -178.14 2.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.296 -0.411 . . . . 63.15 110.64 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -58.89 -42.59 89.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.987 0.422 . . . . 73.34 110.796 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.27 -7.67 55.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.942 -0.572 . . . . 72.44 111.368 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 94.7 25.77 14.61 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.648 -0.787 . . . . 63.02 112.582 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.27 108.38 18.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.8 0.333 . . . . 73.44 110.837 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 144' ' ' VAL . 11.2 p -66.31 124.01 20.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.18 -0.463 . . . . 75.53 111.116 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.434 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 44.8 p90 -110.08 -21.28 12.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.155 -0.475 . . . . 71.4 111.095 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -157.02 127.94 6.73 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.857 0.361 . . . . 74.22 110.997 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 75.1 m -142.79 105.28 4.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 54.1 110.862 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -76.07 -6.52 51.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 73.42 111.323 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.716 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.4 mp . . . . . 0 C--N 1.33 -0.263 0 CA-C-O 120.827 0.346 . . . . 63.42 111.0 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.779 0.323 . . . . 60.53 111.131 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.2 tttt -146.64 145.41 23.09 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 54.43 110.676 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.65 158.02 58.01 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.355 2.037 . . . . 73.33 112.239 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -80.04 127.87 32.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.126 -0.488 . . . . 72.12 110.845 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.612 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.8 OUTLIER -105.73 126.83 52.62 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.272 -0.422 . . . . 74.11 111.047 179.801 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.701 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 20.8 p90 -151.35 141.45 22.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 72.33 110.951 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.605 ' CB ' HG21 ' A' ' 168' ' ' VAL . 2.4 mtpt -69.62 130.81 43.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.305 -0.407 . . . . 71.33 110.909 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.708 HG22 ' O ' ' A' ' 129' ' ' ASP . 33.3 m -87.77 149.32 4.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 63.33 111.057 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 69.04 24.22 75.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.729 -0.748 . . . . 74.21 112.577 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.605 HG21 ' CB ' ' A' ' 165' ' ' LYS . 15.4 m -134.09 46.43 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.915 0.388 . . . . 73.1 111.125 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.29 36.24 2.92 Favored Glycine 0 C--N 1.331 0.302 0 CA-C-N 116.101 -0.499 . . . . 50.4 113.295 179.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . 0.513 ' HG2' HG23 ' A' ' 168' ' ' VAL . 0.3 OUTLIER -82.43 -45.72 14.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.858 0.361 . . . . 74.42 111.089 -179.867 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -119.26 -179.64 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.087 -0.506 . . . . 74.4 110.994 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.557 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -58.35 159.33 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.394 -0.367 . . . . 72.1 111.136 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 7.4 ttt85 -68.04 -27.23 66.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.254 -0.43 . . . . 73.13 111.191 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.3 -36.34 39.91 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.663 -0.78 . . . . 51.02 112.169 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.765 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.2 t90 -78.28 -33.62 49.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.909 0.385 . . . . 72.15 111.109 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -64.42 -38.26 90.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.088 -0.506 . . . . 55.2 110.489 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -73.5 -30.62 63.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.901 -0.59 . . . . 73.02 110.619 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.605 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -79.74 -55.96 4.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.496 . . . . 65.51 111.106 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.701 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 5.3 mt -59.69 -28.78 67.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.933 -0.576 . . . . 74.54 110.809 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.4 mt -60.42 -32.02 70.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.425 . . . . 64.03 110.789 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 63.9 p -92.41 2.45 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 65.03 111.407 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.402 ' HB3' HD12 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -76.24 150.04 37.09 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.741 0.305 . . . . 65.24 110.769 179.916 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.4 165.38 13.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 63.24 111.206 -179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . 0.69 ' HA ' HD22 ' A' ' 220' ' ' LEU . 1.0 OUTLIER -60.49 117.62 5.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.951 -0.568 . . . . 72.52 110.8 179.807 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.53 66.41 2.25 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.675 -0.774 . . . . 71.24 112.319 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . 0.504 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.8 tt0 -144.51 145.81 32.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.602 0.239 . . . . 73.12 110.389 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . 0.449 ' HE2' ' HB2' ' A' ' 9' ' ' ALA . 0.5 OUTLIER -117.55 134.72 54.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.688 0.28 . . . . 74.12 110.332 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.29 168.0 20.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.113 0.482 . . . . 61.23 111.648 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.56 104.43 5.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.64 -0.709 . . . . 70.43 109.882 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.687 HD12 HD11 ' A' ' 192' ' ' ILE . 0.4 OUTLIER -126.52 147.18 49.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.081 0.467 . . . . 45.13 111.832 -179.069 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.843 ' HG3' HG23 ' A' ' 215' ' ' THR . 1.3 mp0 -117.07 125.17 50.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.689 -0.687 . . . . 72.43 110.438 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.687 HD11 HD12 ' A' ' 190' ' ' LEU . 2.4 mm -94.32 152.15 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.881 0.372 . . . . 74.32 111.221 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -87.06 159.11 51.95 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.052 -0.522 . . . . 70.12 110.657 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.37 -44.36 38.74 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.567 2.178 . . . . 55.12 112.228 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -56.34 -39.65 73.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.268 -0.424 . . . . 74.5 111.194 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.444 ' CD2' ' HB3' ' A' ' 110' ' ' LYS . 9.9 m0 -97.37 36.95 1.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.324 -0.398 . . . . 70.11 110.99 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -164.64 -77.52 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.025 -0.534 . . . . 53.33 110.705 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . 0.785 ' CE2' HD11 ' A' ' 214' ' ' LEU . 22.3 m-85 -102.85 -71.22 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 71.14 110.571 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 135.32 175.87 14.06 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.839 -0.696 . . . . 62.52 112.714 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 19.8 mtpt -58.34 -32.38 68.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.879 0.371 . . . . 74.44 110.884 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 11.1 mttm -59.83 -52.95 63.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 62.12 110.729 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 103.58 176.11 26.04 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.822 -0.704 . . . . 45.2 112.499 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.431 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.4 OUTLIER -117.3 81.75 13.86 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.822 0.344 . . . . 75.11 110.791 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.12 -25.26 44.74 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.669 2.246 . . . . 64.45 112.46 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.25 -42.19 94.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.917 0.389 . . . . 64.12 111.04 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -103.82 29.81 5.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.114 -0.494 . . . . 73.25 111.212 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 39.8 mttt 56.09 28.03 12.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.258 -0.428 . . . . 73.2 111.075 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.831 HG12 HD11 ' A' ' 139' ' ' LEU . 40.0 mt -91.38 111.67 50.15 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 73.43 110.992 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -74.0 173.92 13.25 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.491 2.127 . . . . 72.32 112.474 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -51.04 137.91 44.2 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.674 2.249 . . . . 72.24 112.255 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 5.9 p30 42.11 88.81 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.151 -0.477 . . . . 71.25 111.395 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.47 116.27 21.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.319 -0.4 . . . . 55.54 111.398 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 1.6 tptm -65.66 126.58 28.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 64.2 110.378 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.785 HD11 ' CE2' ' A' ' 198' ' ' TYR . 19.1 mt -104.47 109.52 21.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.342 -0.39 . . . . 72.15 111.44 -179.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.843 HG23 ' HG3' ' A' ' 191' ' ' GLU . 52.4 m -102.45 137.31 40.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 70.24 110.563 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.577 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 5.5 p90 -154.94 175.26 14.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.027 0.442 . . . . 75.25 111.331 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -133.01 136.77 46.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.645 . . . . 73.43 110.523 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.765 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.1 t -123.63 150.56 27.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.072 0.463 . . . . 64.32 111.891 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -136.81 111.07 8.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.744 -0.662 . . . . 74.4 110.225 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.74 HD21 HG13 ' A' ' 223' ' ' ILE . 1.9 tt -69.93 129.28 39.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.831 0.348 . . . . 52.54 111.004 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 21.6 t -108.7 -29.32 2.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 64.54 111.421 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . 0.426 ' N ' HD23 ' A' ' 220' ' ' LEU . 5.7 t70 -170.66 161.34 7.49 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.91 0.386 . . . . 53.11 111.018 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.74 HG13 HD21 ' A' ' 220' ' ' LEU . 46.6 mt -139.79 110.43 4.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 74.15 111.051 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . 0.405 ' C ' HG22 ' A' ' 130' ' ' VAL . 27.0 t70 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 74.54 110.952 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.94 HG11 HG21 ' A' ' 136' ' ' THR . 43.0 t . . . . . 0 CA--C 1.529 0.15 0 CA-C-O 120.605 0.24 . . . . 54.24 111.055 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.43 ' HD2' ' CE2' ' A' ' 72' ' ' PHE . 95.1 Cg_endo -78.72 143.84 19.05 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.667 2.244 . . . . 75.54 112.408 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -81.67 151.34 27.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 64.35 110.774 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.57 113.99 0.95 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 74.23 111.182 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -88.07 -16.34 33.84 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.14 -0.482 . . . . 55.22 111.351 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.414 ' CH2' ' HB3' ' A' ' 24' ' ' ASP . 3.9 m-90 -136.34 173.63 11.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.836 0.35 . . . . 63.31 110.719 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.1 m -115.82 150.33 37.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.069 -0.514 . . . . 72.52 110.617 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.626 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.9 t -56.3 -32.06 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.958 0.409 . . . . 71.14 110.772 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -77.01 -24.66 52.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.926 -0.579 . . . . 60.22 111.156 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.421 ' O ' ' HB2' ' A' ' 17' ' ' SER . 3.4 tt0 -82.12 -57.25 3.48 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.851 0.358 . . . . 74.34 110.911 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.631 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.2 mt -51.3 -60.31 3.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.253 -0.43 . . . . 74.24 111.012 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.626 ' HD2' HG12 ' A' ' 12' ' ' VAL . 21.7 mtt180 -57.51 -25.43 59.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.031 -0.531 . . . . 72.53 111.33 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.421 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -59.02 173.06 0.49 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.847 0.356 . . . . 72.32 110.983 -179.867 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -99.78 16.18 24.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.095 -0.502 . . . . 74.12 111.207 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -112.31 -30.35 7.21 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.421 -0.354 . . . . 73.34 110.805 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.924 HD12 HD11 ' A' ' 25' ' ' ILE . 2.4 tm? -75.26 114.27 33.78 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 44.33 110.673 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.681 ' HD2' HD22 ' A' ' 20' ' ' LEU . 34.4 Cg_endo -64.91 123.3 11.42 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.389 2.059 . . . . 71.1 112.488 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.404 ' HB2' ' CD1' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -62.75 -26.52 68.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.04 -0.527 . . . . 75.23 111.254 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.483 ' HA ' HD12 ' A' ' 26' ' ' ILE . 4.2 ttmt -53.54 -37.02 62.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.877 0.37 . . . . 73.42 111.174 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.414 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 0.1 OUTLIER -74.41 -56.1 5.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 72.2 110.845 179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.924 HD11 HD12 ' A' ' 20' ' ' LEU . 42.5 mt -44.89 -32.09 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.83 -0.623 . . . . 72.54 111.44 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.642 ' HB ' HG23 ' A' ' 47' ' ' ILE . 7.6 mt -76.66 -40.68 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 60.03 111.038 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -71.42 -24.91 62.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.893 -0.594 . . . . 73.14 111.21 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -72.36 -45.5 59.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.949 0.404 . . . . 75.42 110.886 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.785 HD21 ' HA ' ' A' ' 63' ' ' TYR . 3.6 mt -68.41 -25.09 64.86 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.859 -0.609 . . . . 73.24 111.053 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -80.95 -24.44 38.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.31 -0.404 . . . . 70.5 111.177 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.42 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -101.26 -7.35 23.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.469 -0.332 . . . . 74.13 111.503 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.42 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.9 m-70 -125.78 -3.13 7.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.7 -0.227 . . . . 73.45 111.606 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.43 161.37 19.91 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.707 -0.758 . . . . 54.33 112.418 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -89.68 149.45 22.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.588 0.233 . . . . 62.42 110.61 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.657 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -49.1 -57.0 7.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.801 0.334 . . . . 73.21 111.075 -179.798 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 14.5 m -47.24 -51.61 18.29 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.217 -0.447 . . . . 71.43 110.852 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.49 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 12.8 t80 -55.19 -44.3 75.19 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.857 -0.61 . . . . 54.53 110.323 179.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.583 HD12 ' HA ' ' A' ' 35' ' ' ASP . 13.4 mt -65.38 -42.4 92.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.015 -0.539 . . . . 73.43 110.665 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.819 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -46.48 -45.35 18.28 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.223 -0.444 . . . . 73.11 111.171 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.28 -25.74 64.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.857 -0.611 . . . . 71.04 110.859 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 67.0 m-70 -112.69 8.49 19.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.253 -0.43 . . . . 74.33 111.166 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt 54.38 33.7 19.14 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.804 0.335 . . . . 74.11 110.905 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.735 HD13 HD13 ' A' ' 29' ' ' LEU . 61.8 mt -92.39 -24.9 18.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 51.54 111.758 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.819 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -73.79 156.66 37.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.092 0.472 . . . . 72.14 111.185 -179.568 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.4 -122.75 5.7 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.671 -0.695 . . . . 61.43 112.378 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.789 ' O ' HG23 ' A' ' 50' ' ' VAL . 4.1 m120 -116.31 119.48 35.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.787 0.327 . . . . 64.03 110.93 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.642 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -45.96 -53.22 2.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.224 -0.444 . . . . 74.35 111.337 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -47.93 -38.2 16.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.887 -0.597 . . . . 54.11 110.961 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -85.61 -25.57 26.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 74.22 111.059 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.789 HG23 ' O ' ' A' ' 46' ' ' ASN . 26.3 t -81.86 -25.83 9.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.343 -0.389 . . . . 62.44 111.396 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.97 -17.13 63.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.384 -0.371 . . . . 73.55 111.438 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.2 pttt -95.19 -35.37 11.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.445 -0.343 . . . . 70.24 110.941 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.4 m -86.2 -23.38 26.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.202 -0.453 . . . . 72.04 111.105 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -101.97 125.9 48.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.373 -0.376 . . . . 74.23 111.161 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.29 175.28 10.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 53.52 110.559 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.684 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -58.1 -58.28 9.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.823 0.344 . . . . 74.12 110.51 179.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.86 -26.08 68.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.109 -0.496 . . . . 74.33 110.578 179.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.48 -43.21 99.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.114 -0.494 . . . . 72.33 110.341 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.619 HD21 HG12 ' A' ' 26' ' ' ILE . 20.8 mt -75.04 -30.11 60.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.631 -0.713 . . . . 65.32 110.998 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 56' ' ' LYS . 14.0 t -79.14 -43.14 24.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.984 0.421 . . . . 65.44 110.759 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.9 m -60.27 -36.21 77.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.823 -0.626 . . . . 72.44 110.707 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.481 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -80.85 -22.31 40.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 75.22 111.0 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.785 ' HA ' HD21 ' A' ' 29' ' ' LEU . 14.2 t80 -83.76 -22.89 31.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.117 -0.492 . . . . 70.25 110.956 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.441 ' ND2' HG12 ' A' ' 60' ' ' VAL . 72.5 m-20 -84.99 -54.35 4.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 75.34 111.342 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.466 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 2.5 p-80 -61.39 -24.49 66.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.06 -0.518 . . . . 75.45 111.179 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.766 HD12 HD23 ' A' ' 29' ' ' LEU . 3.9 tt -55.39 -39.33 70.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.937 0.399 . . . . 53.11 110.835 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -78.25 -38.82 41.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.025 -0.534 . . . . 71.33 110.705 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -37.46 78.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.013 -0.54 . . . . 62.03 111.002 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 45.4 p -90.02 -9.53 48.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.079 -0.509 . . . . 51.1 111.489 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.478 ' HD3' HG11 ' A' ' 144' ' ' VAL . 0.1 OUTLIER 52.25 34.1 13.96 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.764 0.316 . . . . 75.54 111.186 179.833 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.5 mtt180 -93.63 45.18 1.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.289 -0.414 . . . . 72.44 111.048 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.599 ' CE2' HD22 ' A' ' 66' ' ' LEU . 89.9 m-85 -69.0 178.73 2.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.43 . . . . 72.51 110.824 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.3 tttt . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.229 -0.441 . . . . 62.12 110.872 179.909 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.433 ' HE2' ' CD1' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.807 0.337 . . . . 70.4 110.967 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 19.1 p90 -130.88 151.06 51.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 72.44 110.819 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 4.8 m -120.27 128.7 53.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.272 -0.422 . . . . 74.12 110.683 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -124.66 144.25 50.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.338 -0.392 . . . . 71.21 111.0 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.1 t -145.36 117.18 8.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 62.43 110.909 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 24.1 t -74.78 107.31 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 74.4 111.147 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.415 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.9 mm? -77.45 -53.93 7.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 72.42 111.005 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -120.68 108.19 13.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 73.44 111.096 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.75 149.63 21.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 74.11 110.87 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.522 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -121.88 -155.04 9.32 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.637 -0.792 . . . . 71.31 112.662 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -37.93 -53.4 1.34 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.964 0.411 . . . . 73.23 111.436 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.65 36.04 1.32 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.87 -0.604 . . . . 75.31 110.18 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 24.2 m -153.53 -44.09 0.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.645 -0.707 . . . . 70.41 110.663 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -92.82 96.71 10.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 62.54 110.819 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -108.76 151.27 41.67 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 73.32 110.893 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.693 ' HB3' HG11 ' A' ' 166' ' ' VAL . 52.9 Cg_exo -55.04 125.59 19.7 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.517 2.145 . . . . 51.24 112.36 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -101.91 145.55 29.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.098 -0.501 . . . . 74.52 110.9 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -55.21 113.32 1.34 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.255 -0.429 . . . . 63.4 110.95 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.23 -19.61 48.05 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.644 -0.789 . . . . 72.01 112.577 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.59 138.22 31.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.8 0.333 . . . . 75.44 110.823 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.6 HG12 ' HG3' ' A' ' 165' ' ' LYS . 20.8 m -68.58 172.1 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.05 0.452 . . . . 73.25 111.415 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.899 HG22 ' O ' ' A' ' 164' ' ' PHE . 19.5 m -156.75 144.36 10.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.612 -0.722 . . . . 74.43 110.19 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.481 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.76 117.85 22.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.759 0.314 . . . . 71.24 110.99 -179.85 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.459 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 27.0 p -154.76 168.82 25.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.36 -0.382 . . . . 72.13 111.093 -179.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.564 ' O ' HG13 ' A' ' 218' ' ' VAL . 75.5 m95 -102.18 161.58 13.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.057 -0.52 . . . . 64.43 110.129 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.504 ' OH ' HD13 ' A' ' 162' ' ' LEU . 14.1 p90 -159.27 135.05 8.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.042 0.449 . . . . 72.21 111.65 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.94 HG21 HG11 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -127.45 112.92 15.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.792 -0.64 . . . . 71.55 110.394 179.65 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.558 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.94 144.88 17.6 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.564 -0.827 . . . . 64.01 113.137 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.727 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -151.25 140.64 21.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.725 0.298 . . . . 65.15 110.473 179.695 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.43 HD21 HG23 ' A' ' 208' ' ' ILE . 99.2 mt -78.09 -178.04 5.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.325 -0.398 . . . . 72.51 111.173 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -59.04 -42.89 91.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.969 -0.559 . . . . 74.13 110.857 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.31 -4.68 37.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.976 -0.556 . . . . 74.43 111.413 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . 0.498 ' C ' HG22 ' A' ' 138' ' ' THR . . . 89.47 22.0 38.8 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.687 -0.768 . . . . 74.31 112.696 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.85 108.31 19.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.859 0.362 . . . . 73.5 110.683 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.672 ' CG1' HG23 ' A' ' 138' ' ' THR . 3.5 m -68.33 130.33 33.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 64.43 111.247 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.499 ' HB3' HD11 ' A' ' 208' ' ' ILE . 34.8 p90 -110.95 -31.04 7.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 62.21 110.919 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -140.23 124.8 18.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 74.43 110.983 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.843 HG23 HG23 ' A' ' 136' ' ' THR . 29.4 m -142.59 102.86 4.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 61.23 110.736 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 45.3 t30 -76.15 -6.27 50.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 73.11 111.387 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.688 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.6 mp . . . . . 0 C--N 1.33 -0.268 0 CA-C-O 120.844 0.354 . . . . 63.13 111.036 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.834 0.35 . . . . 53.05 111.083 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 17.9 mttt -146.42 109.16 4.19 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 73.33 110.917 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . 0.404 ' HB2' ' HB3' ' A' ' 132' ' ' HIS . 77.2 Cg_exo -50.63 150.37 12.18 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.442 2.095 . . . . 64.31 112.327 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.504 HD13 ' OH ' ' A' ' 135' ' ' TYR . 3.7 tt -74.21 119.28 18.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 60.24 110.631 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.703 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.45 122.1 42.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.885 0.374 . . . . 72.12 111.237 -179.813 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.899 ' O ' HG22 ' A' ' 131' ' ' VAL . 6.8 p90 -151.52 143.1 23.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 74.43 110.874 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.6 ' HG3' HG12 ' A' ' 130' ' ' VAL . 64.3 mttt -78.0 138.28 38.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.037 0.446 . . . . 60.54 111.151 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.693 HG11 ' HB3' ' A' ' 125' ' ' PRO . 28.6 m -87.78 149.11 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.831 -0.622 . . . . 74.11 111.133 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.03 22.57 78.48 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.858 -0.687 . . . . 60.33 112.737 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.561 HG22 ' O ' ' A' ' 165' ' ' LYS . 17.9 m -128.55 42.87 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.846 0.355 . . . . 52.44 111.172 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 40.48 38.19 1.39 Allowed Glycine 0 C--N 1.333 0.391 0 CA-C-N 116.013 -0.54 . . . . 74.31 113.461 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.64 -47.1 10.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.862 0.363 . . . . 74.41 111.131 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.9 m -112.04 -179.9 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.072 -0.513 . . . . 71.22 111.079 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.549 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -60.54 160.62 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.303 -0.408 . . . . 72.25 111.377 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . 0.405 ' HA ' ' OD2' ' A' ' 176' ' ' ASP . 27.6 ttt180 -67.72 -25.83 65.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.1 -0.5 . . . . 75.35 111.285 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -80.31 -33.69 31.33 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.63 -0.795 . . . . 60.13 112.399 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.783 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.5 t90 -80.8 -35.69 32.68 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.071 0.397 . . . . 70.11 112.071 -179.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . 0.405 ' OD2' ' HA ' ' A' ' 173' ' ' ARG . 7.0 p30 -73.04 -31.35 64.37 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.794 0.33 . . . . 44.3 110.277 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -74.59 -30.65 61.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 72.11 110.18 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.473 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -88.0 -45.25 10.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.012 -0.54 . . . . 52.22 111.132 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.62 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 4.8 mt -57.68 -38.7 75.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.13 -0.486 . . . . 72.03 110.607 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 16.5 mt -55.4 -24.19 28.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.124 -0.489 . . . . 73.12 110.937 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.0 -3.99 56.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.227 -0.442 . . . . 54.24 111.417 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.55 154.09 27.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.776 0.322 . . . . 61.54 110.623 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.08 171.52 8.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.977 0.418 . . . . 53.41 111.447 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . 0.61 ' HA ' HD22 ' A' ' 220' ' ' LEU . 24.7 tttt -64.72 120.73 13.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.788 -0.642 . . . . 63.23 110.506 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 67.85 63.8 3.49 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.543 -0.837 . . . . 64.35 112.19 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . 0.522 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 22.3 tt0 -144.57 147.03 32.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.633 0.254 . . . . 74.25 110.403 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -119.42 136.53 54.26 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.271 -0.27 . . . . 71.23 110.271 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.28 168.53 19.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.105 0.479 . . . . 53.55 111.811 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.66 101.01 4.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.589 -0.732 . . . . 74.31 109.874 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.673 HD23 ' H ' ' A' ' 190' ' ' LEU . 2.2 pt? -118.92 145.33 45.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.069 0.462 . . . . 75.41 111.884 -178.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.722 ' HB3' HG23 ' A' ' 215' ' ' THR . 16.2 pt-20 -118.14 116.21 26.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.625 -0.716 . . . . 74.23 110.248 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . . . . . . . . . 25.5 mt -106.89 128.7 61.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.279 -0.419 . . . . 64.44 111.589 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -61.65 164.9 8.42 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.902 -0.59 . . . . 74.22 110.615 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . 0.439 ' HG3' ' HA ' ' A' ' 211' ' ' ASN . 19.6 Cg_endo -58.68 -40.04 76.92 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.591 2.194 . . . . 64.31 112.291 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -53.54 -28.27 30.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 64.04 111.302 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.433 ' CD1' ' HE2' ' A' ' 110' ' ' LYS . 13.8 m0 -110.24 35.3 3.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.845 0.355 . . . . 74.15 111.091 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . 0.433 ' CB ' HD12 ' A' ' 214' ' ' LEU . . . -153.74 -79.93 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 74.23 111.071 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -108.37 -33.69 7.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.405 . . . . 72.13 110.771 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 111.36 177.7 20.32 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.827 -0.701 . . . . 60.55 112.652 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -59.22 -36.32 75.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 70.21 110.838 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.13 -53.15 61.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 62.42 110.653 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 119.95 -151.81 17.25 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.943 -0.646 . . . . 73.12 112.494 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.4 ' CB ' ' HB ' ' A' ' 208' ' ' ILE . 0.6 OUTLIER -143.98 78.14 14.16 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.905 0.383 . . . . 72.53 110.579 179.929 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -55.65 -21.7 32.79 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.599 2.2 . . . . 72.14 112.381 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.52 -42.12 99.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.419 -0.355 . . . . 74.52 110.955 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -111.9 22.68 14.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.188 -0.46 . . . . 65.52 111.356 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 21.5 mttp 58.52 54.46 5.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.916 0.389 . . . . 73.0 111.057 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.499 HD11 ' HB3' ' A' ' 145' ' ' PHE . 23.0 mm -108.81 111.81 60.67 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 72.01 111.017 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.75 163.2 3.04 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.475 2.117 . . . . 73.32 112.447 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.04 128.72 13.37 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.634 2.222 . . . . 71.44 112.338 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . 0.439 ' HA ' ' HG3' ' A' ' 194' ' ' PRO . 22.8 m-80 62.6 66.99 0.73 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.249 -0.432 . . . . 73.2 110.908 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.87 129.74 51.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.264 -0.425 . . . . 74.44 111.539 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . 0.514 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.0 OUTLIER -65.4 143.95 57.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.942 -0.572 . . . . 74.03 110.469 179.718 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.514 HD23 ' O ' ' A' ' 213' ' ' LYS . 9.6 mt -126.94 109.58 12.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.94 0.4 . . . . 63.55 111.779 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.722 HG23 ' HB3' ' A' ' 191' ' ' GLU . 2.7 m -107.67 138.05 44.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.974 -0.557 . . . . 75.21 110.436 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.558 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 22.7 p90 -152.41 175.31 12.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.094 0.473 . . . . 73.1 111.542 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -130.28 134.1 46.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.734 -0.666 . . . . 64.33 110.432 179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.783 HG21 ' HE1' ' A' ' 175' ' ' TRP . 5.8 t -121.73 150.43 25.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.997 0.427 . . . . 74.31 111.898 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -136.94 109.22 7.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.762 -0.654 . . . . 75.13 110.233 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.698 HD21 ' CG1' ' A' ' 223' ' ' ILE . 1.9 tt -70.06 133.25 47.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.504 -0.316 . . . . 63.43 110.975 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.402 ' N ' HD23 ' A' ' 220' ' ' LEU . 21.9 t -112.62 -29.53 2.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.238 -0.437 . . . . 70.33 111.451 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . 0.422 ' N ' HD23 ' A' ' 220' ' ' LEU . 9.4 t70 -169.03 158.59 8.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.907 0.384 . . . . 74.32 111.157 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.784 HG23 HG12 ' A' ' 131' ' ' VAL . 30.7 mt -141.52 111.53 3.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.109 -0.496 . . . . 74.31 111.182 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . 0.534 ' C ' HG22 ' A' ' 130' ' ' VAL . 33.8 t70 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.245 -0.434 . . . . 63.52 110.871 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 1.059 HG11 HG21 ' A' ' 136' ' ' THR . 29.9 t . . . . . 0 CA--C 1.529 0.138 0 CA-C-O 120.558 0.218 . . . . 62.52 111.103 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -79.68 142.53 16.16 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.65 2.234 . . . . 62.1 112.449 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -78.54 147.91 33.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.244 -0.435 . . . . 63.13 110.785 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.97 96.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.213 -0.449 . . . . 74.22 111.285 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.539 ' HB2' ' NZ ' ' A' ' 187' ' ' LYS . . . -66.99 -15.62 63.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 50.32 111.379 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.514 ' NE1' HD11 ' A' ' 20' ' ' LEU . 2.0 m-90 -135.64 173.79 11.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.907 0.384 . . . . 73.31 110.794 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.461 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.3 OUTLIER -117.0 153.26 32.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.978 -0.555 . . . . 72.33 110.517 179.661 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.583 HG12 ' HD2' ' A' ' 16' ' ' ARG . 31.7 t -56.31 -34.05 39.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.396 . . . . 74.45 110.975 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -72.8 -25.67 61.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.532 . . . . 44.13 111.197 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.461 ' HB2' HG23 ' A' ' 11' ' ' THR . 32.3 mt-30 -82.15 -56.57 3.85 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.821 0.343 . . . . 75.23 111.122 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.602 ' HB3' HG22 ' A' ' 60' ' ' VAL . 14.0 mt -49.55 -64.36 0.83 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.284 -0.417 . . . . 63.21 111.123 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.583 ' HD2' HG12 ' A' ' 12' ' ' VAL . 4.7 mtt-85 -54.45 -25.46 25.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.5 . . . . 73.34 111.345 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.13 173.24 0.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.023 0.44 . . . . 73.43 111.31 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -108.25 16.99 22.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.766 -0.652 . . . . 63.13 110.945 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -107.75 -23.61 12.02 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.386 -0.37 . . . . 74.4 111.065 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.814 HD22 HD11 ' A' ' 25' ' ' ILE . 10.0 tt -93.17 116.19 66.12 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.407 -0.36 . . . . 73.22 111.029 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -57.2 126.6 22.61 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.478 2.118 . . . . 74.12 112.198 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -24.11 67.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 64.42 111.203 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.538 ' HA ' HD12 ' A' ' 26' ' ' ILE . 26.4 mmtt -53.74 -36.87 62.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.375 -0.375 . . . . 71.41 111.292 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -72.67 -57.22 4.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.266 -0.425 . . . . 73.51 111.021 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.814 HD11 HD22 ' A' ' 20' ' ' LEU . 36.5 mt -44.77 -30.56 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.892 -0.594 . . . . 71.23 111.466 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.737 ' HB ' HG23 ' A' ' 47' ' ' ILE . 7.7 mt -78.08 -38.83 24.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.931 0.396 . . . . 74.03 111.03 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 mtpt -73.78 -24.9 59.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.96 -0.564 . . . . 53.01 111.131 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -72.96 -45.19 59.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.923 0.392 . . . . 75.52 110.842 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.844 HD23 HD12 ' A' ' 66' ' ' LEU . 3.2 mt -69.27 -24.53 63.98 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.911 -0.586 . . . . 75.22 111.033 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.52 ' HA ' HD11 ' A' ' 38' ' ' LEU . 64.8 mt-30 -80.0 -26.89 39.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.407 . . . . 61.45 111.112 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.425 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -101.8 -1.3 32.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.415 -0.357 . . . . 60.23 111.593 -179.889 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.425 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.7 m-70 -132.6 -10.9 3.14 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.857 0.317 . . . . 74.54 111.857 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.86 105.49 0.81 Allowed Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.603 -0.808 . . . . 54.11 112.372 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -31.94 152.48 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.544 0.572 . . . . 63.45 112.544 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.579 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.6 p-10 -50.09 -56.8 9.41 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.692 -0.685 . . . . 71.21 111.292 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.52 -49.96 17.82 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.032 0.444 . . . . 71.42 110.77 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.453 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 2.4 t80 -52.99 -47.26 68.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.786 -0.643 . . . . 74.1 110.321 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.693 HD21 ' O ' ' A' ' 29' ' ' LEU . 12.1 mt -66.86 -41.48 87.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.938 -0.574 . . . . 65.44 110.853 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.838 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -48.64 -41.84 32.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.093 0.473 . . . . 43.53 110.75 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -49.4 -48.28 47.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.678 -0.692 . . . . 63.3 110.93 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.418 ' CD2' ' N ' ' A' ' 41' ' ' HIS . 2.9 m-70 -103.89 14.86 29.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.042 -0.526 . . . . 74.34 111.201 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 4.8 mtmm 55.51 42.14 30.09 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.889 0.376 . . . . 51.14 111.1 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.708 HD13 HD13 ' A' ' 29' ' ' LEU . 20.3 mt -93.24 -19.43 21.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 65.44 111.532 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.838 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.73 157.81 27.07 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.04 0.448 . . . . 71.41 111.077 -179.863 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.73 -121.55 5.13 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.747 -0.661 . . . . 51.13 112.379 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.787 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.4 OUTLIER -116.36 116.88 28.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.773 0.321 . . . . 54.41 110.92 179.917 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.737 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.9 -54.72 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.237 -0.438 . . . . 73.32 111.33 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -47.09 -36.75 8.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 74.51 110.849 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -85.67 -26.03 26.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.93 -0.577 . . . . 73.12 110.959 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 46' ' ' ASN . 22.8 t -79.8 -26.03 12.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.293 -0.412 . . . . 70.51 111.353 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.61 -23.13 66.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 53.42 111.126 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.21 -30.43 14.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 54.23 110.758 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.2 m -98.2 33.74 2.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 62.14 111.053 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -165.4 135.05 3.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 45.23 111.027 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -94.03 177.33 6.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 74.11 110.964 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.629 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -56.04 -57.79 10.63 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.26 -0.427 . . . . 73.23 111.053 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -58.73 -28.31 65.73 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 70.33 110.577 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.27 -47.25 85.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.957 -0.565 . . . . 54.33 110.905 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.688 HD21 HG12 ' A' ' 26' ' ' ILE . 31.7 mt -73.9 -30.94 62.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.654 -0.703 . . . . 74.41 111.283 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.629 HG23 ' O ' ' A' ' 56' ' ' LYS . 22.3 t -78.84 -43.23 25.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.986 0.422 . . . . 73.34 111.007 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 96.6 m -60.48 -37.84 82.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.945 -0.571 . . . . 72.41 110.71 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.479 ' HB3' HD11 ' A' ' 43' ' ' LEU . . . -78.21 -23.41 47.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 62.24 111.081 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.666 ' HA ' HD21 ' A' ' 29' ' ' LEU . 19.2 t80 -83.96 -53.52 5.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.148 0.499 . . . . 71.14 110.656 179.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.585 ' ND2' HG12 ' A' ' 60' ' ' VAL . 31.2 m-20 -50.56 -57.01 9.15 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.514 -0.766 . . . . 73.24 111.371 -179.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.459 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 3.0 p-80 -63.47 -24.86 68.01 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.155 -0.475 . . . . 73.43 111.193 -179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.844 HD12 HD23 ' A' ' 29' ' ' LEU . 3.7 tt -51.95 -41.39 62.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.907 0.384 . . . . 54.21 110.891 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -79.04 -40.09 32.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.975 -0.557 . . . . 73.25 110.553 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -62.39 -45.19 94.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.979 -0.555 . . . . 65.42 110.676 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 72.7 p -90.75 -1.99 57.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.93 -0.577 . . . . 64.23 111.346 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.1 pttt 45.06 42.16 6.24 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.794 0.331 . . . . 74.12 111.554 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -92.11 47.24 1.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 73.25 110.884 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.517 ' CE2' HD22 ' A' ' 66' ' ' LEU . 87.3 m-85 -73.05 -175.0 1.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 75.31 110.924 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.6 tttt . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.415 . . . . 75.4 110.857 179.907 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.439 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.795 0.331 . . . . 75.4 110.962 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.403 ' CE1' ' HB2' ' A' ' 178' ' ' ALA . 47.3 p90 -151.98 163.73 38.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 73.11 110.852 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . 0.433 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 64.1 m -130.2 103.57 6.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 73.55 110.939 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.46 146.42 34.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 75.21 110.897 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.531 ' O ' HD12 ' A' ' 116' ' ' LEU . 2.1 m -142.23 125.75 16.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 72.14 110.925 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.517 HG13 ' CD ' ' A' ' 186' ' ' GLU . 41.8 t -72.68 106.11 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 62.44 111.451 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.531 HD12 ' O ' ' A' ' 114' ' ' SER . 6.8 mp -75.62 -60.71 2.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 73.32 110.484 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.0 ttpp -111.62 108.07 17.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.954 -0.566 . . . . 73.44 110.64 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.4 mtpt -60.21 137.37 58.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.26 -0.427 . . . . 63.21 111.024 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -104.19 -106.01 3.05 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.762 -0.733 . . . . 61.33 112.198 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.22 -43.94 11.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.958 0.408 . . . . 75.23 110.589 179.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 71.05 36.44 1.42 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.909 -0.587 . . . . 72.51 110.679 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 60.1 m -163.97 -43.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.017 -0.538 . . . . 74.21 110.768 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.35 91.72 6.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 73.21 110.952 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -103.34 149.89 37.43 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.129 -0.487 . . . . 71.33 110.906 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.613 ' HB2' HG21 ' A' ' 166' ' ' VAL . 61.2 Cg_endo -73.14 125.66 10.5 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.597 2.198 . . . . 75.03 112.387 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.91 159.38 15.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 72.55 110.8 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.418 ' HG2' ' HA3' ' A' ' 167' ' ' GLY . 0.0 OUTLIER -58.53 118.45 5.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.343 -0.39 . . . . 74.33 110.965 -179.947 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 103.0 -17.72 51.6 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.762 -0.732 . . . . 4.34 112.499 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.41 133.35 35.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.902 0.382 . . . . 74.23 110.903 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.566 HG12 ' O ' ' A' ' 224' ' ' ASP . 5.7 p -69.96 162.8 3.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.506 . . . . 63.13 110.848 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.77 HG22 ' O ' ' A' ' 164' ' ' PHE . 5.4 m -153.16 144.85 15.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.206 -0.452 . . . . 61.31 111.048 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.465 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.48 117.8 22.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.768 0.318 . . . . 71.33 110.725 179.68 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.488 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.1 p -154.76 168.87 25.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.901 0.381 . . . . 65.35 111.067 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.525 ' O ' HG13 ' A' ' 218' ' ' VAL . 65.2 m95 -102.91 162.62 12.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.012 -0.54 . . . . 71.43 110.195 179.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.69 ' H ' HD11 ' A' ' 149' ' ' ILE . 33.2 p90 -159.93 135.2 8.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.982 0.42 . . . . 72.53 111.458 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 1.059 HG21 HG11 ' A' ' 5' ' ' VAL . 6.8 m -129.32 115.38 17.5 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.847 -0.615 . . . . 62.31 110.337 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.597 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.82 144.26 17.15 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.619 -0.8 . . . . 73.35 113.108 -179.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.74 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -148.11 145.98 28.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.784 0.326 . . . . 74.22 110.548 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 21.9 mt -82.27 -177.97 6.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.277 -0.42 . . . . 64.24 111.159 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -57.63 -42.48 83.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 72.32 110.937 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.94 -5.4 46.0 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.016 -0.538 . . . . 50.53 111.405 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.64 25.84 26.64 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.64 -0.79 . . . . 73.53 112.546 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -95.35 112.2 23.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.339 . . . . 53.12 110.771 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.574 ' CG1' HG23 ' A' ' 138' ' ' THR . 2.5 m -63.6 144.15 14.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.436 . . . . 73.52 111.17 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.434 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 42.2 p90 -120.92 -36.56 3.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 73.53 111.284 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . 0.404 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 59.7 m-20 -158.07 118.04 3.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.906 0.384 . . . . 71.21 111.355 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.444 ' OG1' HG23 ' A' ' 136' ' ' THR . 14.7 t -142.94 129.46 20.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.514 . . . . 64.5 110.491 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.692 ' C ' HD12 ' A' ' 149' ' ' ILE . 19.8 p-10 -96.22 39.32 1.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.8 0.333 . . . . 74.33 111.1 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.692 HD12 ' C ' ' A' ' 148' ' ' ASN . 2.7 mp . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 74.31 110.713 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.78 0.324 . . . . 63.44 111.04 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -136.83 138.4 26.01 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 73.05 110.904 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.76 151.62 31.6 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.384 2.056 . . . . 72.41 112.359 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.569 ' O ' HD23 ' A' ' 162' ' ' LEU . 4.6 tt -76.08 119.95 20.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 61.23 110.572 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.62 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -98.68 122.17 41.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.907 0.384 . . . . 72.51 111.273 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.77 ' O ' HG22 ' A' ' 131' ' ' VAL . 8.4 p90 -151.62 143.55 23.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.014 -0.539 . . . . 75.1 110.724 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.532 ' O ' HG22 ' A' ' 168' ' ' VAL . 14.7 mtmm -80.92 139.11 36.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.082 0.468 . . . . 74.42 111.129 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.613 HG21 ' HB2' ' A' ' 125' ' ' PRO . 34.1 m -87.46 149.46 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.71 -0.677 . . . . 70.23 111.44 -179.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . 0.418 ' HA3' ' HG2' ' A' ' 127' ' ' LYS . . . 70.51 22.54 77.84 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.82 -0.627 . . . . 64.14 112.768 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.614 HG23 ' CG ' ' A' ' 170' ' ' LYS . 17.1 m -129.38 42.29 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 75.42 111.096 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.69 37.47 5.14 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 121.143 -0.551 . . . . 73.22 113.088 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . 0.614 ' CG ' HG23 ' A' ' 168' ' ' VAL . 3.0 mmpt? -86.02 -36.8 19.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.819 0.342 . . . . 61.52 111.131 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.6 m -126.76 179.39 3.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.457 . . . . 72.21 111.19 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.543 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -60.57 159.45 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 73.21 111.301 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -67.41 -27.8 67.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 74.41 111.199 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.96 -36.97 39.75 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.662 -0.78 . . . . 74.04 112.059 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.67 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.4 t90 -78.3 -34.15 48.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.957 0.408 . . . . 74.21 111.113 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . 0.808 ' O ' HD13 ' A' ' 180' ' ' LEU . 35.1 t70 -66.78 -32.21 73.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.948 -0.569 . . . . 54.43 110.675 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -79.06 -29.82 43.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.48 . . . . 72.33 110.837 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.656 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -82.58 -52.38 6.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.234 -0.439 . . . . 75.44 111.181 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.566 HD21 ' NE1' ' A' ' 175' ' ' TRP . 10.2 mt -58.4 -34.89 71.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.988 -0.551 . . . . 73.22 110.842 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.808 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.6 mp -53.68 -37.62 63.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 70.3 111.084 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 39.2 p -84.18 1.99 41.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.037 -0.529 . . . . 73.03 111.518 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.15 151.38 33.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.765 0.317 . . . . 71.24 110.863 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.72 165.76 11.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.291 -0.413 . . . . 71.42 110.938 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.89 124.97 23.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.08 -0.509 . . . . 73.02 111.021 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 67.8 44.15 81.25 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.84 -0.695 . . . . 63.22 112.841 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . 0.517 ' CD ' HG13 ' A' ' 115' ' ' VAL . 13.4 tt0 -126.91 149.94 49.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.581 0.229 . . . . 52.2 110.528 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . 0.539 ' NZ ' ' HB2' ' A' ' 9' ' ' ALA . 4.7 ttmt -117.95 138.17 52.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.098 -0.334 . . . . 64.43 110.098 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -148.23 175.85 10.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.075 0.464 . . . . 54.4 111.846 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.13 133.6 33.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.607 -0.724 . . . . 71.33 109.584 178.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.656 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.1 pt? -140.34 141.18 35.69 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.158 0.504 . . . . 73.53 112.045 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.68 110.36 18.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.587 -0.733 . . . . 72.04 110.257 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.482 HD11 ' CZ ' ' A' ' 216' ' ' PHE . 2.1 mp -96.25 139.44 19.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.916 0.389 . . . . 74.12 111.344 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -73.64 166.38 44.69 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.945 -0.57 . . . . 74.35 110.964 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.56 -14.34 41.87 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.676 2.25 . . . . 73.44 112.608 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -80.38 -30.01 37.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.814 0.34 . . . . 72.43 111.028 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.439 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 15.3 m0 -111.06 36.9 2.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.29 -0.413 . . . . 71.33 111.004 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -153.16 -78.4 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.256 -0.429 . . . . 74.52 111.018 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . 0.668 ' CE2' HD11 ' A' ' 214' ' ' LEU . 24.0 m-85 -106.92 -71.17 0.76 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 62.1 110.792 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 145.74 176.04 19.32 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.83 -0.7 . . . . 51.43 112.596 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -57.5 -25.58 60.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.728 0.299 . . . . 72.22 111.005 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -74.68 -52.02 12.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.998 0.427 . . . . 74.25 110.863 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.78 174.01 24.67 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.854 -0.689 . . . . 54.21 112.533 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.429 ' CB ' HD12 ' A' ' 208' ' ' ILE . 0.0 OUTLIER -106.32 91.27 5.54 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.66 0.267 . . . . 75.1 110.845 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 203' ' ' GLN . 37.4 Cg_endo -66.22 -21.61 54.84 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.509 2.139 . . . . 74.01 112.445 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.39 -41.84 94.65 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.383 -0.371 . . . . 71.11 110.932 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -105.96 30.0 6.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 72.32 111.126 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 21.6 mttp 56.8 29.43 16.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 72.24 111.044 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.606 HD13 ' CE2' ' A' ' 198' ' ' TYR . 30.3 mt -91.11 111.77 50.3 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.304 -0.407 . . . . 60.42 111.013 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -68.55 171.23 13.43 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.461 2.107 . . . . 73.31 112.401 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -67.01 145.84 75.16 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.587 2.191 . . . . 74.41 112.253 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 48.92 73.61 0.22 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.255 -0.429 . . . . 71.25 111.152 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -127.37 113.66 16.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.312 -0.404 . . . . 50.24 111.479 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.08 116.5 6.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.054 -0.521 . . . . 74.04 110.44 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.668 HD11 ' CE2' ' A' ' 198' ' ' TYR . 11.1 mt -93.46 109.87 21.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.162 -0.472 . . . . 63.14 111.568 -179.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . . . . . . . . . 96.4 m -107.43 138.13 44.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.935 -0.575 . . . . 65.15 110.303 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.597 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 14.9 p90 -155.33 179.38 9.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.082 0.467 . . . . 73.24 111.552 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -133.48 136.85 45.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.686 -0.688 . . . . 75.31 110.748 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.67 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.0 t -121.8 151.21 25.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.168 -0.469 . . . . 34.41 111.756 -179.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -136.74 108.78 7.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.793 -0.639 . . . . 71.22 110.365 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.892 HD13 HD11 ' A' ' 223' ' ' ILE . 0.7 OUTLIER -69.83 128.56 36.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.364 -0.38 . . . . 61.32 110.829 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 39.3 t -108.7 -30.05 2.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.25 -0.432 . . . . 71.2 111.023 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -167.14 156.81 10.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.354 -0.384 . . . . 72.42 110.948 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.892 HD11 HD13 ' A' ' 220' ' ' LEU . 4.4 mp -142.75 112.35 2.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.239 -0.437 . . . . 75.43 111.097 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . 0.566 ' O ' HG12 ' A' ' 130' ' ' VAL . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 61.52 110.89 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 1.037 HG11 HG21 ' A' ' 136' ' ' THR . 44.7 t . . . . . 0 CA--C 1.529 0.138 0 CA-C-O 120.634 0.254 . . . . 72.12 110.951 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.443 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 80.3 Cg_endo -78.56 141.96 18.0 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.713 2.275 . . . . 62.02 112.473 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.406 HE22 HD11 ' A' ' 149' ' ' ILE . 5.5 mm100 -79.91 149.35 30.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.126 -0.488 . . . . 73.45 110.975 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.429 ' HD2' HD13 ' A' ' 149' ' ' ILE . 0.0 OUTLIER -49.86 116.61 1.88 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 72.04 111.162 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.29 -13.9 34.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.146 -0.479 . . . . 55.23 111.576 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.678 ' CD1' HD11 ' A' ' 20' ' ' LEU . 2.0 m-90 -137.94 173.73 11.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.961 0.41 . . . . 73.41 110.966 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 m -117.51 151.8 36.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.944 -0.571 . . . . 51.33 110.741 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.554 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.8 t -56.7 -33.09 39.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.948 0.404 . . . . 63.51 110.824 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -75.4 -25.61 57.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.949 -0.568 . . . . 75.32 111.017 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -82.12 -57.45 3.39 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.831 0.348 . . . . 74.14 110.929 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.708 HD23 HG12 ' A' ' 25' ' ' ILE . 1.0 OUTLIER -49.7 -62.98 1.25 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.241 -0.436 . . . . 70.42 111.006 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.554 ' HD2' HG12 ' A' ' 12' ' ' VAL . 17.9 mtt180 -54.07 -24.09 16.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.087 -0.506 . . . . 70.22 111.291 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.31 176.84 0.11 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.891 0.377 . . . . 72.41 111.168 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -110.38 16.81 21.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.98 -0.554 . . . . 72.55 111.194 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -108.9 -24.81 11.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.521 -0.309 . . . . 75.43 111.165 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.678 HD11 ' CD1' ' A' ' 10' ' ' TRP . 1.8 tt -90.95 111.69 49.59 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.388 -0.369 . . . . 75.11 111.03 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -55.97 128.09 28.8 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.448 2.099 . . . . 75.22 112.211 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.874 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -62.66 -24.16 67.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 73.32 111.222 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.468 ' HA ' HD12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -52.04 -41.62 62.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.425 -0.352 . . . . 75.3 111.472 -179.747 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.95 -57.34 4.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.197 -0.456 . . . . 53.01 111.104 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.874 HD12 ' HA ' ' A' ' 22' ' ' LYS . 4.9 mt -44.96 -30.49 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.858 -0.61 . . . . 70.4 111.613 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.665 HG12 HD21 ' A' ' 59' ' ' LEU . 7.5 mt -77.74 -37.85 24.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.938 0.399 . . . . 70.24 110.969 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -73.11 -23.75 60.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.062 -0.517 . . . . 71.31 111.03 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.452 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 34.6 t80 -73.22 -47.02 46.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.06 0.457 . . . . 75.21 110.99 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.815 HD21 ' HA ' ' A' ' 63' ' ' TYR . 4.3 mt -69.11 -27.77 65.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.782 -0.645 . . . . 74.23 111.136 -179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.476 ' HA ' HD11 ' A' ' 38' ' ' LEU . 36.2 mt-30 -75.69 -29.26 58.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.405 . . . . 72.41 110.987 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.405 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 12.7 pt-20 -93.34 -39.65 10.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 71.21 111.113 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.452 ' ND1' ' CZ ' ' A' ' 28' ' ' PHE . 18.3 m170 -90.27 -5.0 56.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.294 -0.412 . . . . 64.41 111.448 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.01 161.94 15.96 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.712 -0.756 . . . . 70.45 112.425 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.81 153.38 18.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.62 0.248 . . . . 71.14 110.501 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.699 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.3 p-10 -48.83 -56.97 7.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.77 0.319 . . . . 74.42 111.066 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.14 -51.24 25.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.053 0.454 . . . . 45.24 110.803 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.508 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 16.5 t80 -53.07 -48.09 67.98 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.803 -0.635 . . . . 71.53 110.453 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.522 HD21 ' O ' ' A' ' 29' ' ' LEU . 13.3 mt -66.18 -40.67 90.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.055 -0.521 . . . . 64.23 110.775 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.767 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.65 -48.19 28.96 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.03 0.443 . . . . 34.13 111.1 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -57.33 -26.68 61.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.713 -0.676 . . . . 34.31 110.94 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.406 ' NE2' ' CE1' ' A' ' 65' ' ' HIS . 67.8 m-70 -112.57 11.07 19.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.283 -0.417 . . . . 74.54 111.248 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.89 34.79 11.0 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.817 0.341 . . . . 62.44 110.901 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.694 HD13 HD13 ' A' ' 29' ' ' LEU . 23.2 mt -93.29 -20.65 20.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 73.33 111.736 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.767 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.39 158.89 27.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.031 0.443 . . . . 71.03 111.102 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.61 -119.6 4.64 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.775 -0.648 . . . . 51.23 112.453 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.883 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.5 OUTLIER -116.4 115.16 25.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.803 0.335 . . . . 61.03 110.891 179.947 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.634 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.41 -57.66 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.164 -0.471 . . . . 73.51 111.499 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -45.68 -37.25 5.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.804 -0.634 . . . . 73.43 111.076 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -85.75 -25.92 26.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.566 . . . . 51.33 111.086 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 46' ' ' ASN . 19.2 t -81.14 -26.36 10.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.304 -0.407 . . . . 60.12 111.459 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.99 -18.02 64.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.403 -0.362 . . . . 64.33 111.365 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -95.2 -34.53 12.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.42 -0.355 . . . . 51.21 111.076 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.46 -19.74 35.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 74.22 111.409 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -116.16 139.26 50.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 64.42 111.255 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -91.42 -177.47 4.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.151 -0.477 . . . . 74.13 110.74 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.566 ' O ' HG23 ' A' ' 60' ' ' VAL . 23.1 mmmt -59.59 -58.02 10.42 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.457 -0.338 . . . . 55.33 110.91 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.94 -27.87 65.73 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.205 -0.452 . . . . 74.44 110.625 179.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.77 -43.11 99.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.958 -0.564 . . . . 72.4 110.756 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.665 HD21 HG12 ' A' ' 26' ' ' ILE . 29.1 mt -76.35 -28.85 56.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.687 -0.688 . . . . 75.1 111.196 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.6 HG22 ' HB3' ' A' ' 15' ' ' LEU . 18.2 t -80.42 -43.93 21.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.001 0.429 . . . . 72.44 110.685 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 72.4 m -59.29 -33.98 71.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.88 -0.6 . . . . 71.35 110.457 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.455 ' HB3' HD11 ' A' ' 43' ' ' LEU . . . -83.23 -21.97 33.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 62.14 110.942 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.815 ' HA ' HD21 ' A' ' 29' ' ' LEU . 15.6 t80 -83.64 -22.84 32.05 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.171 -0.468 . . . . 60.15 111.113 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.52 ' ND2' HG12 ' A' ' 60' ' ' VAL . 34.2 m-80 -84.56 -53.9 5.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.074 0.464 . . . . 70.04 111.321 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.589 ' HD2' HG21 ' A' ' 69' ' ' THR . 2.9 p-80 -60.43 -29.23 68.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.003 -0.544 . . . . 74.23 111.022 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.694 HD12 HD23 ' A' ' 29' ' ' LEU . 5.5 tt -46.73 -42.09 16.17 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.877 0.37 . . . . 71.33 110.985 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.42 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 5.8 m-85 -78.14 -41.08 36.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.997 -0.547 . . . . 54.43 110.276 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -70.31 -13.02 61.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.899 -0.592 . . . . 72.32 111.02 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.589 HG21 ' HD2' ' A' ' 65' ' ' HIS . 39.3 p -110.6 -16.16 13.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.267 -0.424 . . . . 64.2 111.259 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.667 ' HD3' HG21 ' A' ' 144' ' ' VAL . 10.9 mtmm 57.41 29.95 17.79 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.784 0.326 . . . . 73.32 111.043 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.1 mtt85 -95.1 44.07 1.09 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 71.43 110.993 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.433 ' CD2' ' HD2' ' A' ' 6' ' ' PRO . 61.5 m-85 -66.29 174.63 2.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 71.14 110.758 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.293 -0.412 . . . . 75.34 110.856 179.974 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.789 0.328 . . . . 54.33 110.97 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 6.2 p90 -160.99 -171.89 3.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 74.2 110.809 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 18.7 m -156.44 103.71 2.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 75.41 111.282 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.491 ' HD2' ' HB1' ' A' ' 178' ' ' ALA . 15.3 tttt -100.45 150.99 22.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.202 -0.454 . . . . 72.22 110.66 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.401 ' O ' HD22 ' A' ' 116' ' ' LEU . 65.6 m -145.49 123.11 11.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.35 -0.386 . . . . 72.43 111.037 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 32.7 t -80.77 106.36 11.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 50.31 111.187 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.533 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.1 mm? -82.27 -41.56 20.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.448 . . . . 74.1 110.683 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 8.3 tptt -125.29 108.08 11.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 73.45 110.825 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.0 mtmp? -62.1 139.27 58.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 63.41 110.945 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -110.96 -158.48 15.54 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.719 -0.753 . . . . 70.4 112.408 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -35.88 -49.21 0.61 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.913 0.387 . . . . 75.32 111.708 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.553 ' O ' HG23 ' A' ' 122' ' ' THR . 1.2 tmtt? 72.89 37.71 0.79 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.994 -0.548 . . . . 73.24 110.298 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.553 HG23 ' O ' ' A' ' 121' ' ' LYS . 0.8 OUTLIER -164.43 -44.05 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.729 -0.669 . . . . 63.21 110.55 179.874 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -84.82 91.7 8.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.066 -0.515 . . . . 71.25 110.671 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -108.89 154.98 41.55 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.466 . . . . 72.42 110.885 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.611 ' HB2' HG21 ' A' ' 166' ' ' VAL . 62.8 Cg_endo -73.58 125.63 10.23 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.546 2.164 . . . . 74.13 112.407 -179.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.07 157.37 15.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 71.01 110.891 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.0 115.36 3.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 62.41 110.958 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 108.02 -24.02 24.11 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.732 -0.747 . . . . 71.15 112.568 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -84.54 135.27 34.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 63.13 110.797 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.687 HG12 ' HG3' ' A' ' 165' ' ' LYS . 22.7 m -68.21 171.69 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.29 -0.414 . . . . 70.31 111.191 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.907 HG22 ' O ' ' A' ' 164' ' ' PHE . 10.9 m -156.13 145.31 12.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.863 -0.608 . . . . 73.54 110.593 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.437 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.3 OUTLIER -127.6 117.59 22.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.702 0.286 . . . . 75.21 110.818 179.595 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.654 ' HB3' HD22 ' A' ' 220' ' ' LEU . 30.1 p -153.47 169.09 24.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.965 0.412 . . . . 64.15 111.085 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.554 ' HB3' HD11 ' A' ' 149' ' ' ILE . 39.5 m95 -102.5 160.51 14.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.94 -0.573 . . . . 55.4 110.102 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.434 ' CD1' ' N ' ' A' ' 135' ' ' TYR . 3.2 p90 -158.84 134.7 8.87 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.734 -0.386 . . . . 73.44 111.591 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 1.037 HG21 HG11 ' A' ' 5' ' ' VAL . 57.0 m -127.63 112.5 14.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.958 -0.564 . . . . 62.44 110.553 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.643 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.55 143.84 16.81 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.601 -0.809 . . . . 24.1 113.197 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.739 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -151.58 131.01 12.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.724 0.297 . . . . 75.54 110.384 179.717 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.589 HD21 HD12 ' A' ' 208' ' ' ILE . 83.2 mt -59.24 -178.74 0.06 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.399 -0.364 . . . . 52.14 110.951 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -55.24 -40.9 71.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 65.11 110.852 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.56 0.67 41.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.012 -0.54 . . . . 72.21 111.476 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.75 25.82 26.46 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.612 -0.804 . . . . 63.54 112.64 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . 0.563 ' HB ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -81.17 108.67 15.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.778 0.323 . . . . 73.42 110.873 179.997 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.667 HG21 ' HD3' ' A' ' 70' ' ' LYS . 27.5 t -65.89 124.46 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.449 . . . . 74.12 111.161 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.823 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 17.7 p90 -111.49 -28.41 8.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 71.32 111.013 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -161.19 115.33 2.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.31 -0.405 . . . . 62.12 111.007 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.608 HG22 ' H ' ' A' ' 149' ' ' ILE . 55.1 m -125.36 116.41 21.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 53.14 110.891 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -86.12 14.65 6.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.921 -0.581 . . . . 55.54 111.636 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.608 ' H ' HG22 ' A' ' 147' ' ' THR . 14.8 mt . . . . . 0 C--N 1.331 -0.227 0 CA-C-O 120.767 0.318 . . . . 65.11 111.429 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.81 0.338 . . . . 31.34 111.036 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.3 mmtm -138.97 145.94 47.61 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.304 -0.407 . . . . 60.23 110.875 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.09 147.92 61.8 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.492 2.128 . . . . 70.14 112.339 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.527 HD23 ' C ' ' A' ' 162' ' ' LEU . 3.9 tt -69.38 124.72 24.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 75.4 110.682 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.664 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.29 119.64 38.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.862 0.363 . . . . 53.42 111.081 179.803 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.907 ' O ' HG22 ' A' ' 131' ' ' VAL . 5.3 p90 -149.39 140.82 23.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 70.14 110.855 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.687 ' HG3' HG12 ' A' ' 130' ' ' VAL . 75.8 mttt -78.69 139.51 38.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.009 0.433 . . . . 52.31 110.925 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.611 HG21 ' HB2' ' A' ' 125' ' ' PRO . 29.6 m -87.97 148.91 4.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.874 -0.603 . . . . 53.52 111.373 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.1 24.63 74.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.885 -0.674 . . . . 52.42 112.875 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.721 HG23 ' HG3' ' A' ' 170' ' ' LYS . 5.3 m -129.1 42.67 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.821 0.343 . . . . 52.11 111.101 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 41.8 35.45 1.51 Allowed Glycine 0 C--N 1.332 0.33 0 CA-C-N 116.046 -0.525 . . . . 72.23 113.319 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . 0.721 ' HG3' HG23 ' A' ' 168' ' ' VAL . 6.1 mtpp -86.24 -43.65 12.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.814 0.34 . . . . 75.41 111.163 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 5.7 m -115.24 178.17 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.195 -0.457 . . . . 75.23 110.988 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.553 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.92 160.91 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.317 -0.401 . . . . 63.2 111.192 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 3.6 ttp-105 -67.81 -29.05 68.12 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.235 -0.438 . . . . 74.23 111.044 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.9 -37.19 44.9 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.659 -0.781 . . . . 65.14 112.081 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.718 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.0 t90 -78.73 -33.99 46.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.973 0.416 . . . . 74.33 110.983 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . 0.775 ' O ' HD13 ' A' ' 180' ' ' LEU . 4.1 t70 -63.87 -33.87 76.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.872 -0.604 . . . . 62.43 110.497 179.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -78.73 -29.42 45.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.016 -0.538 . . . . 72.0 110.706 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.629 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -80.0 -56.11 4.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 61.24 111.126 179.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.667 HD21 ' NE1' ' A' ' 175' ' ' TRP . 12.5 mt -61.65 -18.96 61.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.899 -0.592 . . . . 74.45 111.128 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.775 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.5 tp -58.38 -27.15 63.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.357 -0.383 . . . . 63.34 111.26 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 47.8 p -111.52 14.01 21.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.494 -0.321 . . . . 75.11 111.717 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.819 ' SD ' HD23 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -71.57 100.72 2.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.882 0.372 . . . . 74.44 110.691 179.869 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.53 159.46 24.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 75.35 111.255 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.52 116.11 4.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.859 -0.61 . . . . 70.21 111.038 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 79.17 11.84 84.64 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.936 -0.649 . . . . 54.01 113.075 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -87.39 146.31 25.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.963 0.411 . . . . 75.22 111.211 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -119.57 135.71 54.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.003 -0.544 . . . . 71.22 109.928 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -150.11 176.37 10.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.099 0.476 . . . . 63.33 111.9 -179.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . 0.404 ' CB ' ' HG2' ' A' ' 217' ' ' GLU . 0.0 OUTLIER -137.43 138.29 39.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.577 -0.738 . . . . 74.21 109.462 178.782 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.661 HD23 ' N ' ' A' ' 190' ' ' LEU . 1.1 pt? -140.15 138.16 35.0 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.281 0.562 . . . . 75.22 112.41 -179.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.751 ' HG2' HG23 ' A' ' 215' ' ' THR . 6.7 mt-10 -113.46 112.61 23.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.235 -0.893 . . . . 74.34 109.86 179.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.477 HD12 ' CE2' ' A' ' 216' ' ' PHE . 1.9 mp -106.6 147.08 12.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.001 0.429 . . . . 73.33 111.596 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.413 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.1 OUTLIER -77.1 167.17 38.89 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.902 -0.59 . . . . 74.12 110.61 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 27.8 Cg_endo -62.4 -29.49 79.32 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.464 2.11 . . . . 70.43 112.384 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -66.15 -38.89 89.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.261 -0.427 . . . . 71.15 111.143 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.445 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 18.8 m0 -96.88 36.9 1.35 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.357 -0.383 . . . . 70.43 111.027 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -158.66 -81.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 64.54 110.836 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -106.17 -71.39 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.972 0.415 . . . . 61.54 110.61 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 144.0 -176.0 23.55 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.756 -0.735 . . . . 50.24 112.743 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt -57.36 -35.26 69.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.866 0.365 . . . . 73.31 110.899 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -52.26 62.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 75.13 110.616 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.26 -143.68 15.73 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.878 -0.677 . . . . 74.12 112.559 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.411 ' HA ' ' HD2' ' A' ' 204' ' ' PRO . 0.8 OUTLIER -151.97 91.15 3.75 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.606 0.241 . . . . 63.14 110.595 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 203' ' ' GLN . 21.5 Cg_endo -61.28 -24.21 78.43 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.548 2.165 . . . . 71.52 112.636 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.69 -42.14 74.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.887 0.375 . . . . 73.15 110.862 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.823 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -99.63 26.69 5.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.031 -0.531 . . . . 63.15 111.325 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.53 32.26 13.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.374 -0.376 . . . . 75.35 111.149 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.589 HD12 HD21 ' A' ' 139' ' ' LEU . 19.1 mm -93.78 111.76 54.07 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 62.34 111.11 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . 0.588 ' HG2' ' HB2' ' A' ' 212' ' ' ALA . 53.6 Cg_endo -69.44 171.1 14.71 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.362 2.042 . . . . 63.51 112.217 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.33 120.75 7.92 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.492 2.128 . . . . 61.33 112.223 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 63.15 71.23 0.52 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 72.43 110.766 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . 0.588 ' HB2' ' HG2' ' A' ' 209' ' ' PRO . . . -123.09 129.06 50.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 54.05 111.432 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.5 tttt -65.43 139.4 58.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.022 -0.535 . . . . 75.33 110.723 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.87 109.6 15.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.416 -0.356 . . . . 74.32 111.318 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.751 HG23 ' HG2' ' A' ' 191' ' ' GLU . 61.2 m -107.88 141.83 38.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 61.53 110.643 179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.643 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 27.0 p90 -158.42 -178.83 7.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.066 0.46 . . . . 73.23 111.684 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . 0.404 ' HG2' ' CB ' ' A' ' 189' ' ' ARG . 3.0 mt-10 -136.86 140.37 42.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.746 -0.661 . . . . 72.4 110.601 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.718 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.4 t -123.93 152.23 29.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.108 0.48 . . . . 63.43 111.913 -178.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -136.64 109.78 7.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.635 -0.711 . . . . 74.32 110.289 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.819 HD23 ' SD ' ' A' ' 182' ' ' MET . 0.2 OUTLIER -69.8 128.7 37.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.401 -0.363 . . . . 62.11 110.776 -179.681 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.42 -32.51 2.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.21 -0.45 . . . . 72.45 111.516 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -169.37 159.78 8.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.866 0.365 . . . . 70.14 111.077 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.675 HD11 HD12 ' A' ' 220' ' ' LEU . 3.4 mp -140.83 110.31 3.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.046 -0.524 . . . . 72.15 111.077 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.421 . . . . 52.52 110.916 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.866 HG11 HG21 ' A' ' 136' ' ' THR . 48.4 t . . . . . 0 CA--C 1.528 0.12 0 CA-C-O 120.588 0.232 . . . . 35.11 110.642 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.453 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 87.1 Cg_endo -79.04 136.08 12.78 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.61 2.207 . . . . 45.41 112.582 -179.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -78.81 157.44 28.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 74.4 110.882 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.91 95.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 61.45 111.171 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.05 -18.0 63.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.489 . . . . 65.23 111.436 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.637 ' CE2' HD11 ' A' ' 20' ' ' LEU . 1.3 m-90 -137.2 173.74 11.36 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.94 0.4 . . . . 71.52 110.897 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.9 m -115.46 150.17 36.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.976 -0.556 . . . . 74.42 110.642 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.454 HG12 ' HD2' ' A' ' 16' ' ' ARG . 38.5 t -56.66 -31.79 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.917 0.389 . . . . 72.03 110.621 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -77.09 -25.56 52.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.968 -0.56 . . . . 72.21 111.042 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -82.21 -58.09 3.1 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.856 0.36 . . . . 75.33 110.833 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.772 ' HB3' HG22 ' A' ' 60' ' ' VAL . 2.6 mt -50.53 -61.08 2.4 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.196 -0.456 . . . . 63.02 111.004 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.568 ' HG3' HG11 ' A' ' 60' ' ' VAL . 22.3 mtt180 -54.16 -24.0 16.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.092 -0.504 . . . . 74.1 111.207 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.81 176.11 0.22 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.936 0.398 . . . . 60.52 111.115 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -110.3 16.65 21.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.022 -0.536 . . . . 71.52 111.161 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -106.9 -25.62 11.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.564 -0.289 . . . . 74.13 111.068 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.637 HD11 ' CE2' ' A' ' 10' ' ' TRP . 2.5 tt -88.05 112.69 50.95 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.413 -0.358 . . . . 42.42 110.957 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.37 125.46 18.99 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.433 2.088 . . . . 64.32 112.368 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.5 -24.12 66.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.162 -0.472 . . . . 75.22 111.156 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.498 ' HA ' HD12 ' A' ' 26' ' ' ILE . 0.6 OUTLIER -54.0 -40.01 66.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.393 -0.367 . . . . 72.24 111.343 -179.786 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.52 -56.79 5.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.219 -0.446 . . . . 72.02 111.063 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.9 mt -44.82 -31.37 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.88 -0.6 . . . . 75.42 111.446 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.647 HG12 HD21 ' A' ' 59' ' ' LEU . 7.7 mt -76.81 -38.8 30.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.931 0.396 . . . . 75.12 110.98 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -72.92 -24.67 60.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.988 -0.551 . . . . 74.01 111.075 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -71.46 -46.83 58.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.035 0.445 . . . . 74.12 110.812 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.813 HD21 ' HA ' ' A' ' 63' ' ' TYR . 6.4 mt -67.77 -25.03 65.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.838 -0.619 . . . . 72.33 110.994 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -78.55 -24.52 45.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.249 -0.432 . . . . 54.51 111.09 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 10.6 pt-20 -93.92 -41.29 9.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.808 0.337 . . . . 73.03 110.838 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.453 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 35.6 m170 -97.28 16.59 19.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 72.12 110.955 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.95 153.7 23.42 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.795 -0.717 . . . . 72.43 112.507 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.7 p -90.62 152.96 20.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.628 0.252 . . . . 40.04 110.507 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.657 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.1 p-10 -49.32 -57.05 7.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.691 0.281 . . . . 71.21 111.116 -179.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.8 t -47.95 -50.68 26.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.009 0.433 . . . . 65.14 110.685 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.458 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 9.0 t80 -53.56 -47.16 70.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.78 -0.646 . . . . 65.12 110.348 179.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.451 HD21 ' O ' ' A' ' 29' ' ' LEU . 12.9 mt -66.29 -41.04 90.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.047 -0.524 . . . . 74.12 110.722 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.802 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -48.26 -45.56 34.66 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.028 0.442 . . . . 73.21 110.943 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -58.43 -27.29 64.2 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.722 -0.672 . . . . 73.44 110.78 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -112.74 11.88 19.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.207 -0.451 . . . . 73.12 111.124 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.9 mptt 51.22 33.61 9.9 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.85 0.357 . . . . 44.44 110.907 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.785 HD13 HD13 ' A' ' 29' ' ' LEU . 46.7 mt -91.35 -22.62 20.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.104 -0.498 . . . . 73.24 111.802 -179.396 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.802 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -77.37 157.98 30.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.018 0.437 . . . . 63.23 111.123 -179.73 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.73 -121.21 5.1 Favored Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 115.807 -0.633 . . . . 62.11 112.446 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.867 ' O ' HG23 ' A' ' 50' ' ' VAL . 2.2 t-20 -116.32 116.29 27.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.746 0.308 . . . . 72.14 110.914 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.55 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.74 -55.83 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.24 -0.437 . . . . 63.02 111.413 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -47.61 -37.88 13.45 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.86 -0.609 . . . . 64.41 111.022 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -85.7 -26.08 26.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.022 -0.536 . . . . 65.41 111.089 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.867 HG23 ' O ' ' A' ' 46' ' ' ASN . 23.7 t -81.2 -25.8 10.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 63.21 111.418 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.1 -15.63 63.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.381 -0.372 . . . . 52.41 111.15 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -95.14 -32.96 12.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.235 -0.439 . . . . 73.54 110.86 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -87.94 -29.67 20.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.22 -0.446 . . . . 71.05 111.042 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -96.2 125.55 40.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.301 -0.409 . . . . 63.23 111.1 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -81.2 175.14 10.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 72.2 110.588 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.556 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -57.98 -58.25 9.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.855 0.36 . . . . 75.55 110.552 179.916 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.9 -26.46 68.61 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.075 -0.512 . . . . 65.51 110.584 179.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.0 -44.23 97.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.094 0.473 . . . . 74.25 110.441 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.647 HD21 HG12 ' A' ' 26' ' ' ILE . 19.2 mt -71.23 -33.68 70.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.635 -0.711 . . . . 75.45 111.046 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.772 HG22 ' HB3' ' A' ' 15' ' ' LEU . 16.4 t -77.38 -42.2 30.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.295 -0.411 . . . . 75.42 110.802 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.4 m -59.61 -34.6 72.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.866 -0.606 . . . . 73.35 110.634 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.485 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -81.96 -21.5 37.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 65.51 111.074 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.813 ' HA ' HD21 ' A' ' 29' ' ' LEU . 11.0 t80 -82.84 -22.89 33.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 74.32 111.029 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -84.37 -53.74 5.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.331 -0.395 . . . . 75.13 111.507 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.458 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.6 p-80 -61.08 -33.09 72.8 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.125 -0.489 . . . . 72.41 111.257 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.691 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.3 tt -47.64 -40.24 19.22 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.962 0.41 . . . . 71.44 111.258 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.406 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.7 m-85 -77.8 -39.02 45.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.029 -0.532 . . . . 75.43 110.679 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -36.28 81.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.92 -0.582 . . . . 63.24 110.988 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.5 p -93.64 -6.65 45.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 71.34 111.475 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.18 36.45 15.81 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.71 0.29 . . . . 72.13 111.186 179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -93.97 44.07 1.12 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.363 -0.381 . . . . 64.13 110.979 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.401 ' HA ' HD21 ' A' ' 66' ' ' LEU . 87.8 m-85 -65.48 174.65 2.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 74.44 110.822 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.2 tttt . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.274 -0.421 . . . . 63.13 110.906 179.901 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.095 0 CA-C-O 120.734 0.302 . . . . 75.04 110.959 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.485 ' CE2' ' HB2' ' A' ' 178' ' ' ALA . 8.0 p90 -154.34 147.9 25.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.278 -0.419 . . . . 64.31 110.882 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 70.7 m -118.01 103.55 10.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 71.02 110.893 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.61 151.46 21.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.331 -0.395 . . . . 70.43 111.117 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.2 m -143.93 124.96 14.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.114 -0.494 . . . . 73.43 110.761 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.601 ' O ' HG13 ' A' ' 115' ' ' VAL . 10.0 p -82.61 108.62 15.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.234 -0.439 . . . . 74.42 111.193 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -84.55 -47.86 10.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 75.32 110.784 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -117.63 107.9 14.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.177 -0.465 . . . . 73.35 110.949 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -62.15 134.35 56.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 65.21 110.917 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -104.52 -160.99 24.13 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.78 -0.724 . . . . 65.24 112.319 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -34.84 -47.33 0.34 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.917 0.389 . . . . 73.25 111.723 -179.411 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.533 ' O ' HG23 ' A' ' 122' ' ' THR . 0.8 OUTLIER 72.44 37.59 0.9 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.945 -0.57 . . . . 74.24 110.484 -179.764 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.533 HG23 ' O ' ' A' ' 121' ' ' LYS . 0.9 OUTLIER -162.08 -44.05 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.921 -0.581 . . . . 73.51 110.758 179.984 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -85.62 97.28 10.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 60.35 110.889 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -112.27 155.21 43.93 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.101 -0.499 . . . . 74.21 110.819 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.753 ' HB2' HG21 ' A' ' 166' ' ' VAL . 63.0 Cg_endo -73.84 125.52 10.0 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.529 2.152 . . . . 74.22 112.57 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -96.07 160.16 14.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.005 -0.543 . . . . 64.3 110.913 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.74 116.12 2.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.234 -0.439 . . . . 70.11 110.981 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . 0.403 ' O ' ' HG2' ' A' ' 165' ' ' LYS . . . 101.08 -28.28 16.74 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.743 -0.742 . . . . 64.43 112.239 -179.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.677 ' O ' HG22 ' A' ' 166' ' ' VAL . 3.9 m-20 -71.68 130.96 42.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.703 0.287 . . . . 73.15 110.4 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' ' 224' ' ' ASP . 12.4 m -73.59 176.17 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.072 0.463 . . . . 74.12 111.423 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.646 HG12 HG23 ' A' ' 223' ' ' ILE . 19.9 m -156.99 146.27 11.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.567 -0.742 . . . . 72.13 110.655 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.418 ' ND1' ' HB3' ' A' ' 163' ' ' SER . 0.5 OUTLIER -124.61 117.27 23.91 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.987 -0.285 . . . . 54.43 110.405 179.275 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.58 ' HB3' HD22 ' A' ' 220' ' ' LEU . 29.7 p -155.38 169.96 23.01 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.075 0.464 . . . . 61.51 111.411 -179.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.621 ' HB3' HD11 ' A' ' 149' ' ' ILE . 60.7 m95 -102.26 160.45 14.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.735 -0.666 . . . . 72.11 110.234 179.369 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.419 ' OH ' HD13 ' A' ' 162' ' ' LEU . 6.1 p90 -158.25 134.64 9.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.977 0.418 . . . . 71.21 111.59 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.866 HG21 HG11 ' A' ' 5' ' ' VAL . 84.8 m -124.84 108.83 12.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.616 . . . . 74.3 110.174 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.644 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -93.76 143.7 16.67 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.594 -0.812 . . . . 73.32 113.38 -179.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.565 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.7 OUTLIER -152.36 134.28 14.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.718 0.294 . . . . 52.42 110.574 179.669 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.438 HD23 HD23 ' A' ' 214' ' ' LEU . 52.9 mt -62.15 -179.73 0.24 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.425 -0.352 . . . . 72.42 110.672 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -54.74 -41.69 70.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.914 0.387 . . . . 64.3 110.836 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -80.68 0.35 34.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.016 -0.538 . . . . 64.03 111.488 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.19 25.85 27.66 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.644 -0.789 . . . . 42.12 112.542 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.8 m -80.77 108.34 14.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.828 0.347 . . . . 64.23 110.943 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 38.3 t -63.81 120.45 10.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 41.14 111.102 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.443 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 21.5 p90 -111.61 -24.43 10.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.222 -0.444 . . . . 70.25 111.104 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -162.18 112.63 1.56 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.799 0.333 . . . . 64.44 111.149 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.485 HG22 ' H ' ' A' ' 149' ' ' ILE . 43.5 m -127.01 113.28 16.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 72.54 110.696 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.51 ' C ' HD12 ' A' ' 149' ' ' ILE . 52.5 t30 -87.1 12.64 11.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 74.53 111.66 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.68 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.5 mp . . . . . 0 C--N 1.332 -0.184 0 CA-C-O 120.857 0.361 . . . . 75.21 111.003 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.529 ' HB1' ' HH2' ' A' ' 134' ' ' TRP . . . . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.79 0.329 . . . . 73.33 111.034 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.1 mttt -132.53 124.32 18.97 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 72.05 110.874 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . 0.401 ' HB2' ' HB3' ' A' ' 132' ' ' HIS . 50.4 Cg_exo -53.98 150.51 30.58 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.493 2.129 . . . . 71.43 112.294 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.419 HD13 ' OH ' ' A' ' 135' ' ' TYR . 0.5 OUTLIER -80.17 128.85 34.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.199 -0.455 . . . . 62.55 110.658 179.909 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.613 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 1.0 OUTLIER -109.45 127.3 54.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.322 -0.399 . . . . 65.55 111.313 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.587 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 25.3 p90 -152.82 143.5 22.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.066 -0.516 . . . . 74.23 110.829 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.603 ' CB ' HG21 ' A' ' 168' ' ' VAL . 2.2 mptt -71.02 132.34 45.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.337 -0.392 . . . . 62.03 110.9 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.753 HG21 ' HB2' ' A' ' 125' ' ' PRO . 33.7 m -87.68 149.26 4.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.142 -0.481 . . . . 64.51 111.06 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.74 24.46 75.47 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.792 -0.718 . . . . 44.4 112.64 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.603 HG21 ' CB ' ' A' ' 165' ' ' LYS . 14.4 m -134.03 46.42 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.845 0.355 . . . . 74.33 111.129 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.28 35.74 2.73 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 121.204 -0.522 . . . . 70.12 113.256 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . 0.58 ' HG2' HG23 ' A' ' 168' ' ' VAL . 12.3 mmtt -81.19 -47.03 13.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.897 0.38 . . . . 74.01 110.952 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . 0.41 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.3 OUTLIER -118.64 -179.09 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.992 -0.549 . . . . 64.23 110.879 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.57 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.4 pt -57.8 158.85 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.418 -0.355 . . . . 71.12 111.074 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 25.5 ttm105 -67.45 -27.15 66.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.235 -0.439 . . . . 63.23 111.273 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.58 -36.65 37.43 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.679 -0.772 . . . . 70.21 112.188 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.726 ' HE1' HG21 ' A' ' 218' ' ' VAL . 1.9 t90 -77.86 -33.68 52.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.954 0.407 . . . . 72.0 111.014 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -62.27 -41.54 98.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.964 -0.562 . . . . 72.53 110.308 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.94 -29.78 65.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.9 -0.591 . . . . 71.43 110.547 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.646 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -78.7 -61.65 1.94 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 71.41 111.246 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.717 HD21 ' NE1' ' A' ' 175' ' ' TRP . 15.1 mt -58.9 -20.44 51.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.978 -0.556 . . . . 73.41 111.23 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 4.1 mt -60.37 -27.21 67.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.774 0.321 . . . . 73.43 110.883 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 69.9 p -107.78 10.27 28.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 73.41 111.598 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.757 ' SD ' HD23 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -73.35 99.41 2.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.87 0.367 . . . . 63.14 110.848 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.17 161.46 19.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 75.32 111.169 -179.557 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . 0.439 ' HG3' HD12 ' A' ' 223' ' ' ILE . 10.8 tttt -59.88 114.99 3.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.827 -0.624 . . . . 72.41 111.227 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 81.3 8.62 86.97 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.961 -0.638 . . . . 72.33 113.126 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -85.4 139.7 31.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.028 0.442 . . . . 74.1 111.404 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -117.08 139.28 50.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.861 -0.609 . . . . 71.41 109.927 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -148.01 175.39 11.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 33.15 112.061 -179.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.63 121.39 17.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.41 -0.813 . . . . 65.12 109.56 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.646 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.5 pt? -134.36 143.42 47.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.346 0.593 . . . . 50.01 112.351 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.878 ' HG2' HG23 ' A' ' 215' ' ' THR . 4.2 mt-10 -114.87 117.42 30.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.135 -0.939 . . . . 71.44 109.945 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.499 HD12 ' CE2' ' A' ' 216' ' ' PHE . 2.2 mt -108.28 137.15 41.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.972 0.415 . . . . 71.02 111.495 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.63 164.94 45.89 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 70.35 110.57 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . 0.464 ' HG3' ' HA ' ' A' ' 211' ' ' ASN . 19.4 Cg_endo -59.03 -35.24 98.79 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.568 2.179 . . . . 54.45 112.226 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -56.54 -43.53 79.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 45.1 111.411 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.446 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 12.5 m0 -96.64 34.96 1.57 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.884 0.373 . . . . 63.02 111.169 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -159.38 -78.78 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.004 -0.544 . . . . 63.02 110.727 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . 0.578 ' CE2' HD13 ' A' ' 208' ' ' ILE . 47.1 m-85 -105.47 -71.28 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.0 0.429 . . . . 64.33 110.401 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.23 178.4 16.43 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.763 -0.732 . . . . 53.41 112.953 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -56.98 -31.7 65.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.811 0.339 . . . . 71.3 110.803 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -53.3 58.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.464 . . . . 75.23 110.609 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 107.61 -147.3 16.35 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.845 -0.693 . . . . 62.42 112.518 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.802 ' CB ' HD12 ' A' ' 208' ' ' ILE . 0.0 OUTLIER -156.61 82.9 3.29 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.779 0.323 . . . . 63.35 110.656 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -51.13 -35.7 52.66 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.749 2.3 . . . . 63.53 112.638 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.7 -42.1 83.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.855 0.359 . . . . 74.45 111.009 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.501 ' HB3' HG13 ' A' ' 208' ' ' ILE . . . -101.77 27.17 6.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.052 -0.522 . . . . 74.35 111.361 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 51.7 31.04 7.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.366 -0.379 . . . . 74.14 111.09 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.802 HD12 ' CB ' ' A' ' 203' ' ' GLN . 24.5 mt -89.17 111.71 46.77 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 51.23 111.181 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . 0.549 ' O ' ' HB2' ' A' ' 212' ' ' ALA . 70.6 Cg_endo -74.5 164.85 33.0 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.451 2.101 . . . . 71.32 112.397 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.99 147.89 50.36 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.651 2.234 . . . . 73.12 112.347 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . 0.464 ' HA ' ' HG3' ' A' ' 194' ' ' PRO . 70.7 m-80 51.13 36.22 15.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 73.12 111.03 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 209' ' ' PRO . . . -82.58 142.14 32.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 43.32 111.978 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -97.24 159.2 15.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.677 -0.692 . . . . 62.43 109.873 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.543 HD11 ' CD2' ' A' ' 198' ' ' TYR . 3.0 mt -134.39 108.99 8.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.988 0.423 . . . . 74.43 111.951 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.878 HG23 ' HG2' ' A' ' 191' ' ' GLU . 25.5 m -103.06 139.68 38.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.873 -0.603 . . . . 75.02 110.449 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.644 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 12.4 p90 -158.75 179.27 9.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.097 0.475 . . . . 70.11 111.894 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -136.67 140.32 42.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.543 -0.753 . . . . 71.14 110.593 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.726 HG21 ' HE1' ' A' ' 175' ' ' TRP . 4.4 t -124.12 151.8 29.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.087 0.47 . . . . 62.25 111.986 -178.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . 0.427 ' O ' ' HB2' ' A' ' 133' ' ' CYS . 25.4 tt0 -135.97 109.21 7.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.608 -0.724 . . . . 73.02 110.106 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.757 HD23 ' SD ' ' A' ' 182' ' ' MET . 0.2 OUTLIER -69.71 127.89 34.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.313 -0.403 . . . . 71.04 110.936 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 22.0 t -109.06 -29.46 2.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.167 -0.469 . . . . 63.13 111.33 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -169.59 160.34 8.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.412 -0.358 . . . . 64.25 110.916 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.646 HG23 HG12 ' A' ' 131' ' ' VAL . 3.4 mp -139.24 110.17 4.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 62.14 111.106 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . 0.563 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 73.04 110.892 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.957 HG11 HG21 ' A' ' 136' ' ' THR . 24.0 t . . . . . 0 CA--C 1.528 0.106 0 CA-C-O 120.58 0.229 . . . . 65.24 111.165 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.449 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.5 Cg_endo -78.4 137.61 15.02 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.608 2.206 . . . . 71.33 112.419 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.402 ' O ' ' N ' ' A' ' 9' ' ' ALA . 7.6 mm-40 -80.2 154.72 27.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.246 -0.433 . . . . 71.41 110.852 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.543 HH11 HD12 ' A' ' 149' ' ' ILE . 0.0 OUTLIER -52.34 89.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.107 -0.497 . . . . 72.45 111.373 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.402 ' N ' ' O ' ' A' ' 7' ' ' GLN . . . -60.69 -34.55 74.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 73.04 111.056 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.427 ' CE2' HD11 ' A' ' 20' ' ' LEU . 1.5 m-90 -116.09 173.74 6.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.489 . . . . 72.53 110.965 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.3 m -116.25 152.18 34.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.944 -0.571 . . . . 41.41 110.535 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.55 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.9 t -56.6 -33.64 40.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.912 0.386 . . . . 62.51 110.854 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -74.13 -25.7 59.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.989 -0.55 . . . . 74.21 111.181 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -82.12 -56.91 3.65 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.806 0.336 . . . . 73.44 110.994 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.69 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.2 mt -49.6 -63.73 1.02 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.258 -0.428 . . . . 61.33 111.116 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.552 ' HG3' HG11 ' A' ' 60' ' ' VAL . 22.5 mtt180 -53.92 -24.72 17.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.484 . . . . 73.43 111.187 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.17 178.23 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.034 0.445 . . . . 72.11 111.256 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -110.41 17.05 21.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.827 -0.624 . . . . 72.22 111.179 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.67 -24.89 11.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.588 -0.278 . . . . 73.44 111.231 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.523 HD22 HD11 ' A' ' 25' ' ' ILE . 6.2 tt -89.07 116.27 65.88 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.414 -0.357 . . . . 74.44 111.054 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.29 124.41 15.81 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.437 2.091 . . . . 60.33 112.235 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.458 ' O ' HD12 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -60.77 -24.18 65.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 64.14 111.206 -179.942 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -57.75 -32.97 67.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.388 -0.369 . . . . 73.24 111.335 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -78.87 -53.07 7.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.923 0.392 . . . . 62.14 111.133 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.673 ' O ' HD12 ' A' ' 29' ' ' LEU . 34.9 mt -46.54 -35.66 2.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.899 -0.592 . . . . 63.31 111.411 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.692 ' HB ' HG23 ' A' ' 47' ' ' ILE . 6.2 mt -75.74 -44.72 39.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 63.13 111.012 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.78 -25.18 64.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.01 -0.541 . . . . 72.35 110.925 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 38.3 t80 -70.05 -44.01 70.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 74.21 110.65 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.729 HD21 ' HA ' ' A' ' 63' ' ' TYR . 2.5 mt -71.32 -24.21 62.08 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.752 -0.658 . . . . 75.2 110.92 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -76.34 -25.15 54.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.282 -0.417 . . . . 71.23 110.803 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -102.35 -10.51 19.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.236 -0.438 . . . . 72.11 111.095 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 13.1 m170 -117.09 -11.43 10.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.425 -0.352 . . . . 72.22 111.371 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -120.3 164.69 13.8 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.679 -0.772 . . . . 34.43 112.391 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.77 149.58 21.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.599 0.238 . . . . 73.12 110.468 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.594 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -48.51 -57.15 6.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.79 0.328 . . . . 62.35 111.016 -179.82 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.3 p -47.89 -51.67 22.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.909 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.516 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 4.7 t80 -53.48 -46.85 70.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.835 -0.621 . . . . 62.02 110.387 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.512 HD22 ' HB3' ' A' ' 43' ' ' LEU . 13.2 mt -65.34 -41.47 93.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.0 -0.545 . . . . 71.04 110.744 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.852 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -48.11 -43.64 31.21 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.961 0.41 . . . . 54.21 111.034 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -58.87 -27.96 65.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.905 -0.589 . . . . 63.53 110.834 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 39.1 m-70 -112.75 10.28 19.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.155 -0.475 . . . . 71.32 111.169 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.4 mttp 55.24 36.98 28.2 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.89 0.376 . . . . 53.03 110.823 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.555 HD21 HD23 ' A' ' 59' ' ' LEU . 11.7 mt -94.97 -21.84 18.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.109 -0.496 . . . . 72.33 111.898 -179.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.852 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -77.24 155.51 32.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.12 0.486 . . . . 73.13 111.201 -179.756 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.27 -123.51 5.89 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.626 -0.715 . . . . 71.11 112.427 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.658 ' O ' HG23 ' A' ' 50' ' ' VAL . 2.4 m-80 -116.38 118.04 31.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.75 0.309 . . . . 61.42 110.986 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.692 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.1 mp -45.16 -52.22 2.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.167 -0.47 . . . . 53.35 111.401 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -47.34 -37.16 10.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.907 -0.588 . . . . 52.12 110.974 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -85.65 -25.67 26.45 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.921 -0.581 . . . . 73.24 111.205 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.658 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.5 t -83.45 -25.94 7.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.384 -0.371 . . . . 73.52 111.453 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.78 -17.93 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.441 -0.345 . . . . 61.54 111.406 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.6 pttp -95.09 -33.8 12.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.829 0.347 . . . . 73.42 110.995 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.5 m -87.38 -31.0 20.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.228 -0.442 . . . . 60.5 111.031 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.68 127.7 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 63.11 111.17 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -83.41 176.77 8.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 73.42 110.683 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.536 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -58.54 -58.25 9.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.869 0.366 . . . . 72.01 110.515 179.918 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.39 -29.49 70.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.141 -0.481 . . . . 74.54 110.308 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -42.22 98.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 74.41 110.435 179.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.555 HD23 HD21 ' A' ' 43' ' ' LEU . 71.8 mt -72.03 -35.75 69.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.734 -0.666 . . . . 72.22 110.87 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.69 HG22 ' HB3' ' A' ' 15' ' ' LEU . 17.3 t -75.57 -41.24 41.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.213 -0.449 . . . . 72.21 110.826 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.6 m -60.45 -34.0 73.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.895 -0.593 . . . . 52.44 110.428 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.426 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -80.7 -21.24 41.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 72.53 110.932 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.729 ' HA ' HD21 ' A' ' 29' ' ' LEU . 62.1 t80 -83.86 -22.95 31.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.077 -0.51 . . . . 74.44 111.017 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -84.89 -54.51 4.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.23 -0.441 . . . . 73.34 111.512 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.516 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.4 p-80 -61.31 -26.28 67.68 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.076 -0.511 . . . . 75.03 111.056 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.664 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.7 tt -53.08 -39.81 63.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.938 0.399 . . . . 54.24 110.976 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -78.23 -37.66 44.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.981 -0.554 . . . . 74.2 110.599 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.62 -36.51 78.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.974 -0.557 . . . . 64.13 110.818 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 46.6 p -88.9 -9.82 50.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.033 -0.531 . . . . 73.1 111.454 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 50.5 37.69 16.53 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.754 0.312 . . . . 64.25 111.234 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 37.1 mtt180 -100.3 47.54 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.286 -0.416 . . . . 64.05 110.975 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.434 ' CD2' ' HD2' ' A' ' 6' ' ' PRO . 75.1 m-85 -69.22 178.61 2.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.164 -0.471 . . . . 74.23 110.924 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 55.44 110.749 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.436 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.853 0.359 . . . . 74.43 110.936 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.511 ' CE2' ' HB2' ' A' ' 178' ' ' ALA . 41.4 p90 -151.59 155.08 37.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.273 -0.421 . . . . 61.23 110.931 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 71.5 m -122.88 103.5 8.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.161 -0.472 . . . . 71.21 110.845 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.508 ' CE ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -89.48 151.38 22.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.275 -0.421 . . . . 63.4 111.125 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.426 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.9 OUTLIER -144.89 112.83 6.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 54.25 110.837 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.508 HG22 ' CE ' ' A' ' 113' ' ' LYS . 19.5 t -81.94 106.36 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 72.24 111.29 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.556 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.0 mm? -83.21 -41.81 17.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 72.22 110.844 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 4.6 tptt -128.44 108.13 10.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 73.12 110.984 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -59.44 144.67 46.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 72.02 110.966 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.513 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -115.66 -156.55 11.03 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.721 -0.752 . . . . 52.5 112.642 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -35.84 -52.32 0.72 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.022 0.439 . . . . 62.33 111.576 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.9 tttp 69.9 33.47 2.82 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.834 -0.621 . . . . 64.11 110.325 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -152.33 -44.57 0.1 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.796 -0.638 . . . . 64.21 110.651 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . 0.401 ' HB2' ' HB2' ' A' ' 184' ' ' LYS . 13.7 m120 -91.01 98.41 11.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 74.31 110.841 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -108.08 157.16 36.91 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 71.42 110.913 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.636 ' HA ' HG21 ' A' ' 223' ' ' ILE . 58.7 Cg_endo -71.93 125.83 11.34 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.577 2.185 . . . . 63.24 112.407 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -96.88 155.08 16.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 74.44 110.889 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -62.69 117.12 5.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 70.42 110.861 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 104.78 -22.96 32.43 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.612 -0.804 . . . . 74.34 112.647 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -85.95 140.17 30.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.756 0.312 . . . . 65.2 110.818 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.698 HG12 ' HG3' ' A' ' 165' ' ' LYS . 22.2 m -69.09 173.24 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.971 0.415 . . . . 71.43 111.328 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.901 HG22 ' O ' ' A' ' 164' ' ' PHE . 15.9 m -156.89 145.77 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.717 -0.674 . . . . 62.53 110.588 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.461 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.95 117.89 22.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.659 0.266 . . . . 75.01 110.665 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.434 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 25.1 p -150.28 173.92 13.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.118 0.485 . . . . 71.32 111.407 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.842 ' HB3' HD11 ' A' ' 149' ' ' ILE . 87.5 m95 -108.25 157.58 18.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.552 -0.749 . . . . 72.35 110.057 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.478 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 40.3 p90 -162.23 138.37 7.67 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.223 0.535 . . . . 64.42 112.145 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.957 HG21 HG11 ' A' ' 5' ' ' VAL . 12.3 m -129.69 114.57 16.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.426 -0.806 . . . . 71.04 110.151 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.619 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.06 146.01 18.11 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.544 -0.836 . . . . 54.52 113.328 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.747 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -151.22 147.8 27.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.816 0.341 . . . . 73.2 110.766 179.711 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.484 ' HA ' HD23 ' A' ' 139' ' ' LEU . 12.6 mt -81.72 -177.18 6.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 63.3 110.851 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -59.66 -43.1 94.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.45 . . . . 74.02 110.885 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.04 -5.73 56.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.981 -0.554 . . . . 72.44 111.357 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 98.44 25.42 10.11 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.7 -0.762 . . . . 34.22 112.648 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.08 109.65 20.69 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.827 0.346 . . . . 71.01 110.761 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.498 HG12 HG23 ' A' ' 138' ' ' THR . 3.0 m -63.69 135.1 28.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.446 . . . . 63.32 111.296 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.437 ' CD1' ' N ' ' A' ' 146' ' ' ASP . 21.0 p90 -116.85 -40.99 3.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.094 -0.503 . . . . 53.24 110.643 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . 0.437 ' N ' ' CD1' ' A' ' 145' ' ' PHE . 70.6 m-20 -143.65 110.3 5.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.914 -0.584 . . . . 60.0 110.374 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.427 ' CG2' HG23 ' A' ' 136' ' ' THR . 25.0 m -134.1 107.72 7.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.941 0.401 . . . . 73.23 111.455 -179.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.478 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 27.8 t30 -90.32 44.3 1.19 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.958 -0.565 . . . . 70.14 110.21 179.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.842 HD11 ' HB3' ' A' ' 134' ' ' TRP . 35.5 mm . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 61.12 110.893 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.798 0.333 . . . . 50.04 111.075 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 13.5 mmtt -140.8 145.97 42.12 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 65.53 110.897 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -69.71 152.93 69.68 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.549 2.166 . . . . 51.42 112.31 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.442 HD23 ' HD1' ' A' ' 164' ' ' PHE . 2.0 tt -73.67 123.09 23.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 74.44 110.48 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.682 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.39 120.83 40.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.939 0.4 . . . . 75.43 111.266 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.901 ' O ' HG22 ' A' ' 131' ' ' VAL . 13.9 p90 -149.67 141.13 23.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.029 -0.532 . . . . 74.44 110.786 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.698 ' HG3' HG12 ' A' ' 130' ' ' VAL . 28.2 mtmt -77.34 138.17 39.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.958 0.409 . . . . 72.1 110.895 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.602 HG21 ' HB2' ' A' ' 125' ' ' PRO . 29.8 m -87.5 148.92 4.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.945 -0.57 . . . . 71.45 111.051 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 66.01 25.59 72.11 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.688 -0.768 . . . . 73.23 112.098 -179.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.56 HG21 ' HB3' ' A' ' 165' ' ' LYS . 1.9 t -130.98 40.98 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.843 0.354 . . . . 74.31 111.016 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.54 35.18 5.38 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 121.05 -0.595 . . . . 72.41 112.966 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.31 -47.05 11.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.906 0.384 . . . . 73.05 111.064 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.3 m -117.48 179.73 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.095 -0.502 . . . . 73.21 111.058 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.527 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -59.95 160.11 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.332 -0.394 . . . . 61.42 111.12 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -68.04 -28.89 67.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.264 -0.426 . . . . 74.01 111.193 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.83 -37.82 43.6 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.64 -0.79 . . . . 74.14 111.943 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.716 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.3 t90 -79.03 -34.06 44.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.043 0.449 . . . . 65.41 110.964 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . 0.645 ' O ' HD13 ' A' ' 180' ' ' LEU . 36.0 t70 -65.16 -31.16 72.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.756 -0.656 . . . . 74.12 110.602 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -82.0 -28.53 32.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 75.14 110.833 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.628 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -80.32 -62.01 1.81 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.226 -0.443 . . . . 61.31 111.168 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.675 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 6.4 mt -50.29 -32.56 17.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.972 -0.558 . . . . 65.51 110.824 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.645 HD13 ' O ' ' A' ' 176' ' ' ASP . 0.3 OUTLIER -54.54 -24.58 21.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.138 -0.483 . . . . 71.13 110.957 179.734 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 24.9 p -97.54 1.84 49.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.253 -0.431 . . . . 62.4 111.707 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.567 ' HE1' ' O ' ' A' ' 218' ' ' VAL . 0.0 OUTLIER -79.68 152.77 29.75 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.765 0.316 . . . . 64.41 110.565 179.773 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 10.3 p -120.94 173.07 7.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.977 0.418 . . . . 74.5 111.505 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . 0.596 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -64.61 117.4 7.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.808 -0.633 . . . . 74.05 110.574 179.721 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.43 66.46 2.24 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.614 -0.803 . . . . 44.14 112.085 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . 0.513 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 30.9 tt0 -145.05 144.4 30.96 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.623 0.249 . . . . 74.54 110.461 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -119.26 137.24 53.8 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.204 -0.295 . . . . 63.13 110.204 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -144.26 173.1 12.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.149 0.499 . . . . 75.03 111.865 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.57 101.14 4.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.527 -0.761 . . . . 52.44 109.752 179.413 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.807 HD12 HD11 ' A' ' 192' ' ' ILE . 1.0 OUTLIER -115.61 142.26 46.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.123 0.487 . . . . 64.44 111.947 -178.827 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.854 ' HB3' HG23 ' A' ' 215' ' ' THR . 4.8 pt-20 -114.14 119.28 36.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.651 -0.704 . . . . 74.25 110.207 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.807 HD11 HD12 ' A' ' 190' ' ' LEU . 1.8 mm -99.51 143.93 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.858 0.361 . . . . 65.23 111.262 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.42 165.4 46.54 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.075 -0.512 . . . . 71.41 110.602 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -64.51 -43.57 13.32 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.486 2.124 . . . . 72.14 112.264 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -54.67 -24.28 21.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 63.31 111.304 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.436 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 8.5 m0 -115.93 36.94 3.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.404 -0.362 . . . . 75.24 111.122 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -156.67 -81.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.259 -0.428 . . . . 61.42 111.363 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . 0.771 ' CE2' HD13 ' A' ' 208' ' ' ILE . 17.2 m-85 -104.76 -31.19 9.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.899 0.381 . . . . 70.23 110.937 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 107.25 168.42 22.09 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.747 -0.74 . . . . 52.13 112.575 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -30.62 67.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.846 0.355 . . . . 72.11 110.896 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 6.8 pttt -59.91 -48.12 83.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.245 -0.434 . . . . 71.52 110.754 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.68 161.78 24.08 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.801 -0.714 . . . . 74.32 112.467 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.783 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.3 OUTLIER -105.77 89.1 3.27 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 120.65 0.262 . . . . 74.52 110.809 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.37 -22.25 52.83 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.502 2.134 . . . . 64.51 112.369 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.3 -40.51 82.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.304 -0.407 . . . . 62.3 110.923 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -109.26 27.13 9.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 73.44 111.254 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 11.0 tttt 56.84 54.4 7.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.249 -0.432 . . . . 74.31 111.044 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.783 HD12 ' HB3' ' A' ' 203' ' ' GLN . 42.4 mt -118.36 111.68 38.13 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 74.42 111.125 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.37 172.54 1.86 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.516 2.144 . . . . 75.23 112.309 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.2 127.53 12.09 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.583 2.188 . . . . 71.13 112.332 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 30.3 m-20 63.9 71.23 0.49 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.277 -0.419 . . . . 62.43 110.852 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.84 128.59 49.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 54.43 111.248 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -65.59 141.37 58.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.477 . . . . 65.11 110.735 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.593 HD11 ' CE2' ' A' ' 198' ' ' TYR . 22.8 mt -121.79 109.61 14.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 74.23 111.117 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.854 HG23 ' HB3' ' A' ' 191' ' ' GLU . 0.2 OUTLIER -107.95 136.83 46.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.36 -0.382 . . . . 72.33 110.778 179.911 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.619 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 18.0 p90 -152.92 176.94 11.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.992 0.425 . . . . 74.5 111.268 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -130.92 135.0 47.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.843 -0.617 . . . . 75.22 110.31 179.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.716 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.6 t -120.24 150.13 22.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.076 0.465 . . . . 63.44 112.122 -178.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -136.75 107.63 6.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.617 -0.72 . . . . 75.41 110.192 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.596 HD22 ' HA ' ' A' ' 184' ' ' LYS . 3.0 tt -70.37 134.47 47.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.38 -0.373 . . . . 73.53 111.046 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.419 ' N ' HD23 ' A' ' 220' ' ' LEU . 20.9 t -111.3 -29.81 2.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.207 -0.451 . . . . 75.03 111.446 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . 0.477 ' N ' HD23 ' A' ' 220' ' ' LEU . 2.0 t0 -173.0 163.87 4.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.855 0.359 . . . . 71.2 111.112 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.682 HG23 HG12 ' A' ' 131' ' ' VAL . 2.7 mp -139.86 110.42 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 73.45 110.984 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . 0.559 ' O ' HG22 ' A' ' 130' ' ' VAL . 1.6 m-20 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 74.13 110.836 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 1.13 HG11 HG21 ' A' ' 136' ' ' THR . 34.9 t . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.636 0.255 . . . . 72.52 111.112 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.448 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.7 Cg_endo -78.42 142.54 18.75 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.615 2.21 . . . . 41.42 112.512 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.416 ' HB2' ' HB3' ' A' ' 217' ' ' GLU . 7.2 tp60 -83.84 153.48 24.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 71.42 110.833 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.17 110.45 0.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.184 -0.462 . . . . 70.34 111.327 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.56 -18.98 43.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.495 . . . . 64.21 111.2 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.582 ' CD1' HD11 ' A' ' 20' ' ' LEU . 1.4 m-90 -135.01 172.92 12.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.067 0.461 . . . . 62.05 110.761 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.4 m -110.2 148.58 31.56 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.731 -0.668 . . . . 53.15 110.103 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.48 ' O ' ' CG ' ' A' ' 16' ' ' ARG . 58.2 t -56.32 -33.58 38.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.96 0.41 . . . . 74.45 110.211 179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -69.92 -25.74 63.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.803 -0.635 . . . . 72.03 110.791 179.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.417 ' O ' ' HB2' ' A' ' 17' ' ' SER . 0.1 OUTLIER -82.02 -54.9 4.93 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.337 -0.392 . . . . 72.13 111.273 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.795 ' HB3' HG22 ' A' ' 60' ' ' VAL . 4.4 mt -50.0 -66.71 0.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.082 0.401 . . . . 51.5 112.082 -178.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.48 ' CG ' ' O ' ' A' ' 12' ' ' VAL . 1.8 ptm180 -61.59 -23.09 65.77 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 120.895 -0.322 . . . . 70.13 111.622 -178.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.417 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -54.61 178.57 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.739 0.304 . . . . 70.41 110.847 179.773 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -110.27 11.39 23.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.326 -0.397 . . . . 73.44 111.434 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -103.47 -26.18 12.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.765 0.317 . . . . 64.14 111.12 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.63 HD22 HD11 ' A' ' 25' ' ' ILE . 8.5 tt -87.53 130.72 46.24 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.348 -0.387 . . . . 74.11 110.91 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -74.25 127.92 11.65 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.505 2.137 . . . . 54.14 112.369 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -25.06 66.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 74.13 111.193 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.54 ' HA ' HD12 ' A' ' 26' ' ' ILE . 11.8 mmtp -54.08 -39.19 66.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.852 0.358 . . . . 72.34 111.351 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.43 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 0.8 OUTLIER -70.05 -58.35 3.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.198 -0.456 . . . . 74.51 111.093 -179.896 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.63 HD11 HD22 ' A' ' 20' ' ' LEU . 17.9 mt -44.7 -32.62 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.864 -0.607 . . . . 62.53 111.577 -179.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.643 HG12 HD21 ' A' ' 59' ' ' LEU . 8.1 mt -75.11 -37.2 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.363 -0.381 . . . . 74.14 111.008 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 mttm -72.43 -23.88 61.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.016 -0.538 . . . . 71.41 111.258 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -73.73 -45.88 49.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.967 0.413 . . . . 73.14 110.917 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.915 HD13 HD13 ' A' ' 43' ' ' LEU . 4.6 mt -67.89 -24.96 65.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.862 -0.608 . . . . 74.1 110.998 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -80.46 -27.86 37.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.35 -0.386 . . . . 74.01 110.98 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.42 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 15.7 pt-20 -94.01 -41.63 9.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.298 -0.41 . . . . 63.04 111.034 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.448 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 21.2 m170 -98.51 16.54 21.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.285 -0.416 . . . . 65.12 111.035 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.26 154.37 23.98 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.81 -0.71 . . . . 64.44 112.525 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.1 p -88.6 148.26 24.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.66 0.267 . . . . 72.45 110.653 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.584 ' HA ' HD12 ' A' ' 38' ' ' LEU . 0.5 OUTLIER -48.8 -57.12 6.87 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.784 0.325 . . . . 61.52 110.988 -179.874 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.5 t -48.03 -51.15 25.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.195 -0.457 . . . . 71.53 110.724 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.498 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 17.1 t80 -55.12 -45.55 75.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.759 -0.655 . . . . 75.24 110.16 179.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.656 HD21 ' O ' ' A' ' 29' ' ' LEU . 14.7 mt -63.47 -43.56 96.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.933 -0.576 . . . . 70.43 110.477 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.881 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.5 -34.26 7.29 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.13 -0.487 . . . . 62.12 110.575 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -50.55 -48.36 57.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.65 -0.704 . . . . 51.03 110.76 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -106.36 16.25 25.01 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.947 -0.57 . . . . 74.32 110.883 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.8 mttt 57.27 40.95 27.45 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.833 0.349 . . . . 75.15 110.952 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.915 HD13 HD13 ' A' ' 29' ' ' LEU . 51.0 mt -91.59 -25.38 19.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 34.03 111.597 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.881 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -69.79 158.34 35.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.017 0.437 . . . . 60.4 111.114 -179.761 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.19 -124.77 6.45 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.775 -0.648 . . . . 75.2 112.359 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.834 ' O ' HG23 ' A' ' 50' ' ' VAL . 3.4 m120 -116.39 122.57 45.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.794 0.33 . . . . 61.1 110.88 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.578 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -46.13 -49.4 5.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.219 -0.446 . . . . 73.11 111.29 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.5 mttt -50.75 -39.56 52.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.98 -0.555 . . . . 71.22 110.846 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -85.68 -26.28 26.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.869 -0.605 . . . . 73.3 110.934 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.834 HG23 ' O ' ' A' ' 46' ' ' ASN . 28.5 t -78.8 -25.85 13.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 75.12 111.284 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.56 -19.98 64.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.398 -0.364 . . . . 71.2 111.252 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.1 ptpt -95.06 -33.05 12.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.379 -0.373 . . . . 73.21 110.909 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.83 31.79 2.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 73.52 110.977 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -156.08 125.07 6.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 41.33 111.061 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -84.07 171.7 12.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 65.21 110.722 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.637 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.1 OUTLIER -55.71 -58.08 9.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.917 0.389 . . . . 74.54 110.556 179.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.3 -25.71 67.3 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.036 -0.529 . . . . 44.43 110.537 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -46.83 84.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 54.23 110.515 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.643 HD21 HG12 ' A' ' 26' ' ' ILE . 21.9 mt -72.15 -31.18 65.74 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.657 -0.702 . . . . 64.45 111.228 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.795 HG22 ' HB3' ' A' ' 15' ' ' LEU . 15.2 t -79.75 -42.82 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.974 0.416 . . . . 53.31 110.907 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 92.2 m -59.33 -38.02 79.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.941 -0.572 . . . . 73.25 110.774 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.418 ' HA ' ' ND1' ' A' ' 65' ' ' HIS . . . -80.89 -21.81 40.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.314 -0.403 . . . . 65.25 111.108 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.638 ' HA ' HD21 ' A' ' 29' ' ' LEU . 12.9 t80 -82.85 -22.87 33.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 54.43 110.986 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 31.8 m-20 -84.97 -53.62 5.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 45.45 111.583 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.498 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.2 p-80 -61.6 -30.3 70.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.134 -0.485 . . . . 75.23 111.364 -179.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.729 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.1 tt -50.21 -39.83 45.43 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.875 0.369 . . . . 72.03 111.101 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -78.8 -36.79 42.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.065 -0.516 . . . . 64.32 110.598 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.12 -38.16 81.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 73.23 110.843 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.8 p -92.73 -6.25 49.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.024 -0.535 . . . . 64.04 111.387 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt 51.55 36.53 17.28 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.768 0.318 . . . . 73.55 111.34 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 41.9 mtt-85 -93.48 44.18 1.13 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.34 -0.391 . . . . 72.21 111.026 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.498 ' HA ' HD21 ' A' ' 66' ' ' LEU . 85.3 m-85 -64.59 173.12 2.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.297 -0.41 . . . . 73.44 110.786 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 53.1 tttp . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.273 -0.422 . . . . 72.54 110.9 -179.996 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.47 ' CG ' ' CD1' ' A' ' 196' ' ' TRP . 8.4 mmtt . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.658 0.266 . . . . 55.13 111.043 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -132.62 151.16 52.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.904 0.383 . . . . 71.32 111.022 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 63.8 m -130.94 103.64 6.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.034 -0.53 . . . . 64.11 111.099 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -101.73 142.31 33.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.331 -0.395 . . . . 74.13 110.978 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.593 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.5 m -140.78 118.0 11.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.477 . . . . 45.0 110.76 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.415 HG12 ' N ' ' A' ' 116' ' ' LEU . 39.7 t -57.65 154.75 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 75.22 111.336 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.593 HD12 ' O ' ' A' ' 114' ' ' SER . 4.1 mp -132.8 -46.59 0.87 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.977 -0.556 . . . . 71.3 110.571 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.7 tttm -130.42 108.23 9.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.006 -0.543 . . . . 70.15 110.707 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 20.0 pttt -61.2 131.54 50.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 40.4 110.913 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -100.12 -106.06 2.76 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.713 -0.756 . . . . 74.1 112.345 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.44 -40.21 11.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.916 0.389 . . . . 75.43 110.733 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.9 mtmt 66.75 32.56 6.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.969 -0.56 . . . . 70.12 110.686 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 63.3 m -148.61 -45.14 0.15 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.06 -0.518 . . . . 71.23 110.947 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -91.24 122.24 33.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 54.51 111.0 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -129.07 147.55 65.33 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 75.11 110.88 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.454 ' HA ' HG21 ' A' ' 223' ' ' ILE . 52.6 Cg_exo -52.96 127.4 24.76 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.592 2.195 . . . . 61.41 112.472 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.2 140.66 32.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.182 -0.463 . . . . 74.55 110.777 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -51.88 113.71 1.08 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.242 -0.436 . . . . 72.21 111.172 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.89 -15.14 55.75 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.729 -0.748 . . . . 75.23 112.741 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -88.1 140.95 28.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.826 0.346 . . . . 74.31 111.028 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.588 HG12 ' O ' ' A' ' 224' ' ' ASP . 7.6 p -70.91 163.29 3.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.08 -0.509 . . . . 74.31 110.974 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.933 HG12 HG23 ' A' ' 223' ' ' ILE . 14.0 m -155.21 146.76 13.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 74.2 111.176 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.469 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.64 118.0 23.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.711 0.291 . . . . 65.12 110.751 179.705 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.425 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 28.1 p -149.04 166.59 28.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.035 0.445 . . . . 62.24 111.207 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.921 ' HB3' HD11 ' A' ' 149' ' ' ILE . 93.3 m95 -101.8 160.16 14.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.766 -0.652 . . . . 73.15 110.261 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.449 ' CE2' ' ND2' ' A' ' 148' ' ' ASN . 53.1 p90 -163.28 139.48 6.99 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.129 0.49 . . . . 75.21 112.1 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 1.13 HG21 HG11 ' A' ' 5' ' ' VAL . 6.9 m -131.22 116.04 17.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.575 -0.739 . . . . 74.42 110.108 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.572 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.65 144.61 17.34 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.661 -0.78 . . . . 43.24 113.443 -179.26 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.633 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -151.75 136.32 16.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.808 0.337 . . . . 74.43 110.411 179.717 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.53 HD21 HD12 ' A' ' 208' ' ' ILE . 31.3 mt -67.81 -178.34 0.94 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 63.24 110.979 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -56.59 -42.1 78.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 75.15 110.89 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.43 -2.48 35.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.976 -0.557 . . . . 74.13 111.504 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . 0.442 ' C ' HG22 ' A' ' 138' ' ' THR . . . 88.57 25.78 29.38 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.664 -0.779 . . . . 50.52 112.672 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 31.0 m -90.61 116.37 28.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.8 0.333 . . . . 72.44 110.816 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.438 HG22 HG23 ' A' ' 138' ' ' THR . 24.1 t -63.61 130.24 28.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 73.52 111.064 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.759 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 55.1 p90 -114.68 -31.06 6.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 63.0 111.106 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . 0.42 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 2.7 m-20 -168.1 117.5 0.77 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.385 -0.371 . . . . 71.41 111.072 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.552 ' OG1' HG23 ' A' ' 136' ' ' THR . 15.0 t -142.87 129.52 20.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 75.01 110.94 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.449 ' ND2' ' CE2' ' A' ' 135' ' ' TYR . 35.8 p-10 -92.54 50.08 1.56 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.262 -0.426 . . . . 64.35 110.373 179.544 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.921 HD11 ' HB3' ' A' ' 134' ' ' TRP . 19.2 mm . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.126 -0.488 . . . . 74.3 110.893 -179.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 120.837 0.351 . . . . 51.13 111.032 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -137.13 133.76 18.61 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 64.11 110.897 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . 0.413 ' HB2' ' HB3' ' A' ' 132' ' ' HIS . 34.5 Cg_exo -56.95 155.94 25.97 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.37 2.047 . . . . 63.25 112.204 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.442 ' O ' HD23 ' A' ' 162' ' ' LEU . 2.6 tt -77.96 119.67 21.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.452 . . . . 73.32 110.382 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.648 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -97.69 121.84 40.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.395 . . . . 75.14 111.384 -179.721 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.881 ' O ' HG22 ' A' ' 131' ' ' VAL . 10.8 p90 -150.36 142.67 24.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.995 -0.548 . . . . 63.45 110.597 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.49 ' HB3' HG21 ' A' ' 168' ' ' VAL . 7.2 mtpt -81.26 141.03 34.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.981 0.42 . . . . 65.04 111.028 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.448 HG11 ' CB ' ' A' ' 125' ' ' PRO . 27.0 m -87.44 149.18 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.837 -0.62 . . . . 52.32 111.138 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 66.91 26.28 73.2 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.792 -0.718 . . . . 34.3 112.269 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.49 HG21 ' HB3' ' A' ' 165' ' ' LYS . 2.0 t -131.18 41.19 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.831 0.348 . . . . 75.43 110.984 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.02 34.84 3.23 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 121.105 -0.569 . . . . 73.3 112.966 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.62 -45.8 13.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.885 0.374 . . . . 73.04 111.016 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.1 m -118.41 179.55 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.042 -0.526 . . . . 64.12 111.066 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.537 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -61.82 159.07 2.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.262 -0.426 . . . . 74.43 111.246 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -65.08 -30.16 71.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.158 -0.474 . . . . 72.51 111.292 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.8 -36.21 43.04 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.529 -0.843 . . . . 45.44 112.197 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.723 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.5 t90 -80.22 -36.06 35.3 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.914 0.388 . . . . 63.42 110.91 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -60.89 -36.4 79.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.993 -0.549 . . . . 75.4 110.37 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . 0.763 ' O ' HG23 ' A' ' 181' ' ' THR . 3.9 mm-40 -78.04 -29.04 49.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.957 -0.565 . . . . 71.02 110.627 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.654 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -77.71 -60.44 2.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.202 -0.453 . . . . 75.04 111.144 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.669 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 7.1 mt -55.54 -35.98 66.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.984 -0.553 . . . . 50.32 110.897 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.7 tp -62.11 -28.77 69.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.224 -0.444 . . . . 70.12 110.835 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . 0.763 HG23 ' O ' ' A' ' 177' ' ' GLU . 37.0 p -89.32 -8.54 53.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 75.14 111.369 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 9.4 mmm -75.47 159.4 31.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.762 0.315 . . . . 75.24 110.829 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.91 166.78 10.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 73.23 111.079 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . 0.716 ' HA ' HD22 ' A' ' 220' ' ' LEU . 5.5 tttm -65.56 123.35 19.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 53.44 111.095 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 70.24 39.27 71.79 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.737 -0.744 . . . . 55.25 112.702 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -121.16 149.78 42.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.834 0.35 . . . . 71.41 110.999 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -116.53 139.29 50.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 63.33 110.226 179.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -147.79 175.84 10.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.058 0.456 . . . . 71.12 111.642 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.7 124.49 21.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.722 -0.672 . . . . 73.23 109.838 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.702 HD11 ' CD1' ' A' ' 175' ' ' TRP . 1.3 pt? -135.91 142.14 44.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.187 0.518 . . . . 74.33 112.152 -179.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.687 ' HG3' HG23 ' A' ' 215' ' ' THR . 0.6 OUTLIER -117.35 113.42 22.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.416 -0.811 . . . . 62.52 110.15 179.302 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.574 HG21 ' O ' ' A' ' 196' ' ' TRP . 4.6 mp -96.57 142.77 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.975 0.417 . . . . 55.42 111.458 -179.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -78.77 164.43 55.51 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 115.88 -0.6 . . . . 73.12 110.834 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.83 -41.43 75.53 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.661 2.241 . . . . 42.04 112.409 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -63.28 -39.0 93.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 71.03 111.162 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.574 ' O ' HG21 ' A' ' 192' ' ' ILE . 9.0 m0 -96.3 27.1 3.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.359 -0.382 . . . . 74.33 111.103 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -150.04 -81.84 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 34.3 110.792 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -104.25 -71.27 0.74 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.039 0.447 . . . . 74.21 110.444 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 145.83 -174.36 25.82 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.823 -0.703 . . . . 72.02 112.808 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -56.9 -40.96 77.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.826 0.346 . . . . 71.23 110.895 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.46 -52.01 65.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.126 -0.488 . . . . 73.52 110.592 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.1 -139.46 14.56 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.84 -0.695 . . . . 63.13 112.519 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.406 ' HA ' ' HD2' ' A' ' 204' ' ' PRO . 2.1 mm-40 -150.89 90.35 4.19 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 120.656 0.265 . . . . 64.42 110.621 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 203' ' ' GLN . 23.8 Cg_endo -61.86 -22.57 74.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.523 2.149 . . . . 72.11 112.668 -179.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.65 -42.18 64.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.86 0.362 . . . . 72.14 110.889 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.759 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -97.59 25.76 5.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.064 -0.516 . . . . 74.22 111.358 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 54.71 32.45 17.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.344 -0.389 . . . . 63.34 111.16 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.53 HD12 HD21 ' A' ' 139' ' ' LEU . 20.2 mm -95.72 111.79 56.96 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 73.44 111.118 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . 0.788 ' HG2' ' HB2' ' A' ' 212' ' ' ALA . 39.9 Cg_endo -67.23 171.46 11.48 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.34 2.027 . . . . 75.1 112.171 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -68.72 122.17 9.1 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.535 2.157 . . . . 53.44 112.314 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 71.42 34.47 1.7 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.214 -0.448 . . . . 75.04 110.988 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . 0.788 ' HB2' ' HG2' ' A' ' 209' ' ' PRO . . . -83.86 147.38 27.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.046 0.45 . . . . 65.31 111.768 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . 0.453 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.1 OUTLIER -88.62 148.05 24.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.776 -0.647 . . . . 53.02 110.367 179.473 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.453 HD23 ' O ' ' A' ' 213' ' ' LYS . 5.5 mt -130.03 109.11 10.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.883 0.373 . . . . 63.54 111.767 -179.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.687 HG23 ' HG3' ' A' ' 191' ' ' GLU . 50.3 m -111.3 141.45 44.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.109 -0.496 . . . . 70.13 110.612 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.572 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 11.6 p90 -153.96 178.17 10.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.107 0.48 . . . . 70.23 111.717 -179.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . 0.462 ' OE2' HD22 ' A' ' 116' ' ' LEU . 1.4 mt-10 -127.9 132.13 49.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.604 -0.725 . . . . 63.3 110.123 179.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.723 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.4 t -120.8 149.04 23.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.121 0.486 . . . . 64.45 112.034 -178.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -136.73 109.85 7.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.584 -0.734 . . . . 75.14 110.253 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.778 HD21 HG13 ' A' ' 223' ' ' ILE . 3.2 tt -69.92 134.33 48.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.342 -0.39 . . . . 71.14 110.89 -179.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.441 ' N ' HD23 ' A' ' 220' ' ' LEU . 40.4 t -112.08 -29.96 2.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.252 -0.431 . . . . 50.14 111.392 -179.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . 0.455 ' N ' HD23 ' A' ' 220' ' ' LEU . 13.4 t70 -168.82 158.71 9.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.821 0.343 . . . . 62.31 111.176 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.933 HG23 HG12 ' A' ' 131' ' ' VAL . 35.1 mt -141.62 111.53 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 72.53 111.168 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . 0.588 ' O ' HG12 ' A' ' 130' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 75.31 110.841 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.511 HG23 ' OG1' ' A' ' 138' ' ' THR . 60.5 t . . . . . 0 CA--C 1.53 0.19 0 CA-C-O 120.636 0.255 . . . . 71.21 111.086 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.414 ' HD2' ' CE1' ' A' ' 72' ' ' PHE . 90.2 Cg_endo -80.7 146.15 16.59 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.813 2.342 . . . . 62.31 112.469 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.458 ' OE1' HD11 ' A' ' 149' ' ' ILE . 3.2 tp-100 -84.34 152.21 24.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 75.22 110.743 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 mpp_? -52.4 121.31 6.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 65.03 111.116 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -93.78 -13.05 27.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 72.22 111.376 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.631 ' NE1' HD11 ' A' ' 20' ' ' LEU . 1.2 m-90 -137.12 173.73 11.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.877 0.37 . . . . 74.24 110.681 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 m -117.11 151.36 36.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.06 -0.518 . . . . 70.33 110.58 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.522 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.4 t -57.18 -33.17 42.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.065 0.46 . . . . 65.03 110.364 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.53 -28.25 61.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.696 -0.684 . . . . 74.44 111.058 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -82.06 -57.75 3.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.323 -0.399 . . . . 74.41 110.994 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.756 ' HB3' HG22 ' A' ' 60' ' ' VAL . 2.5 mt -50.32 -62.24 1.7 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.198 -0.456 . . . . 64.43 111.092 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.531 ' HG3' HG11 ' A' ' 60' ' ' VAL . 26.0 mtt180 -54.37 -24.35 19.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 65.3 111.268 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.98 173.69 0.31 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.334 -0.394 . . . . 45.51 111.082 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.32 16.35 21.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 64.43 111.237 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -107.73 -25.32 11.33 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.547 -0.297 . . . . 74.42 111.011 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.941 HD22 HD11 ' A' ' 25' ' ' ILE . 10.3 tt -86.13 129.48 53.69 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.293 -0.412 . . . . 73.21 110.874 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.29 123.14 9.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.332 2.021 . . . . 43.34 112.32 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -24.06 66.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 74.24 111.211 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.9 mmtp -53.38 -39.31 64.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.396 -0.365 . . . . 61.44 111.396 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -79.02 -29.04 43.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.324 -0.398 . . . . 73.4 111.209 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.941 HD11 HD22 ' A' ' 20' ' ' LEU . 49.0 mt -66.18 -37.12 79.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.32 -0.4 . . . . 55.1 111.096 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.702 HG12 HD21 ' A' ' 59' ' ' LEU . 10.3 mt -72.53 -44.47 61.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 73.11 110.938 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.417 ' HG3' HD11 ' A' ' 47' ' ' ILE . 1.2 mtpt -59.53 -24.17 63.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.847 -0.615 . . . . 71.32 111.026 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -74.87 -50.08 18.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 73.21 110.894 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.898 HD23 HD12 ' A' ' 66' ' ' LEU . 5.1 mt -65.13 -40.69 94.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.963 -0.562 . . . . 70.53 110.919 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -67.89 -23.73 65.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.219 -0.446 . . . . 41.04 110.492 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -88.03 -48.21 7.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.086 -0.506 . . . . 75.55 110.885 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -97.23 16.44 19.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 63.05 111.307 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -131.34 151.93 19.86 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.661 -0.781 . . . . 62.1 112.408 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.83 154.05 19.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.685 0.279 . . . . 73.04 110.618 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.541 ' O ' HD21 ' A' ' 44' ' ' LEU . 0.7 OUTLIER -46.98 -52.67 14.14 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.527 -0.306 . . . . 55.14 111.337 -179.806 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 57.8 m -53.01 -46.54 68.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.012 0.434 . . . . 42.01 110.68 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.455 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 11.2 t80 -56.6 -48.25 77.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.785 -0.643 . . . . 54.31 110.726 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.718 HD22 ' HB3' ' A' ' 43' ' ' LEU . 13.4 mt -63.46 -45.2 91.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 74.3 110.889 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.929 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -48.07 -34.01 8.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 71.2 111.155 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -59.22 -55.39 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.996 -0.547 . . . . 55.11 111.025 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 -95.59 15.29 20.25 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.175 -0.466 . . . . 75.11 111.411 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 mttp 60.08 38.24 20.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.736 0.303 . . . . 71.22 111.182 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.718 ' HB3' HD22 ' A' ' 38' ' ' LEU . 14.3 mt -85.12 -21.76 29.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.373 -0.376 . . . . 62.3 110.796 179.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.929 HD11 ' HB2' ' A' ' 39' ' ' ALA . 81.2 mt -47.08 170.82 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.175 -0.466 . . . . 63.31 111.344 179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.71 -148.95 20.2 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.913 -0.661 . . . . 52.32 112.869 179.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.824 ' O ' HG23 ' A' ' 50' ' ' VAL . 4.6 m-20 -114.85 149.16 37.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.005 0.431 . . . . 73.52 111.16 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.699 HG23 HD12 ' A' ' 26' ' ' ILE . 3.4 mp -45.62 -42.03 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.847 -0.615 . . . . 55.31 111.599 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.21 -43.45 82.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.961 -0.563 . . . . 75.13 111.198 -179.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -85.71 -27.1 25.51 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.076 -0.511 . . . . 74.45 111.292 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 46' ' ' ASN . 35.3 t -76.74 -26.2 16.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.386 -0.37 . . . . 73.13 111.441 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.78 -25.39 65.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.442 -0.344 . . . . 33.2 111.366 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.29 -30.54 13.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 73.44 111.103 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -84.05 -19.76 33.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.264 -0.426 . . . . 42.52 111.471 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -117.74 130.13 56.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.865 0.364 . . . . 74.51 111.32 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -78.65 -179.09 6.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 73.01 110.48 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.571 ' O ' HG23 ' A' ' 60' ' ' VAL . 2.5 tpmp? -61.4 -58.45 8.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.796 0.332 . . . . 73.13 110.524 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -25.51 67.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.196 -0.456 . . . . 75.44 110.646 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.04 -40.06 94.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.11 0.481 . . . . 73.25 110.214 179.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.702 HD21 HG12 ' A' ' 26' ' ' ILE . 15.3 mt -77.07 -30.14 55.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.619 -0.719 . . . . 73.22 111.013 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.756 HG22 ' HB3' ' A' ' 15' ' ' LEU . 17.3 t -79.66 -43.48 23.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.991 0.424 . . . . 75.32 110.737 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 63.7 m -59.32 -34.8 72.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.945 -0.571 . . . . 61.5 110.448 179.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.446 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -82.64 -21.19 35.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.544 . . . . 72.01 110.997 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.78 ' HA ' HD21 ' A' ' 29' ' ' LEU . 14.2 t80 -83.63 -22.64 32.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.094 -0.503 . . . . 74.43 110.918 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 30.2 m-20 -85.06 -53.88 4.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 73.44 111.401 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.428 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.8 p-80 -62.33 -27.27 68.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.097 -0.501 . . . . 73.44 111.323 -179.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.898 HD12 HD23 ' A' ' 29' ' ' LEU . 3.8 tt -50.82 -40.79 56.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.899 0.38 . . . . 63.3 111.065 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.405 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.6 m-85 -79.05 -40.06 32.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.035 -0.53 . . . . 74.02 110.679 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -64.88 -39.75 94.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.961 -0.563 . . . . 74.32 110.972 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.2 p -88.98 -10.38 47.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.001 -0.545 . . . . 61.23 111.399 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt 53.55 33.21 15.77 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.683 0.277 . . . . 60.32 111.21 179.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -92.42 45.84 1.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 75.32 111.026 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.476 ' CE1' HD22 ' A' ' 66' ' ' LEU . 94.5 m-85 -64.86 171.87 3.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 62.4 110.801 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 33.9 tttt . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.325 -0.398 . . . . 73.31 110.914 179.975 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.442 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.768 0.318 . . . . 73.41 111.048 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.476 ' CE1' ' HB2' ' A' ' 178' ' ' ALA . 29.5 p90 -152.64 151.61 30.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.295 -0.412 . . . . 73.33 110.848 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 74.1 m -122.14 103.54 8.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 72.04 110.857 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.9 ttpt -95.92 145.52 25.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.328 -0.397 . . . . 73.1 111.11 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.428 ' O ' HD22 ' A' ' 116' ' ' LEU . 1.7 m -138.35 117.78 12.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 34.45 110.727 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 22.8 t -81.07 106.36 12.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.294 -0.412 . . . . 44.34 111.267 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.533 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -82.23 -42.0 19.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 74.32 110.67 179.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -125.05 107.72 11.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 53.4 110.927 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.1 mtmp? -63.64 139.29 58.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 62.35 110.953 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -112.67 -155.02 12.09 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.779 -0.724 . . . . 64.22 112.279 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -33.59 -50.46 0.34 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.917 0.389 . . . . 62.35 111.705 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.1 tttt 71.65 35.64 1.39 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.028 -0.533 . . . . 63.32 110.177 -179.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 75.0 m -163.62 -43.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.664 -0.698 . . . . 71.34 110.525 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -85.3 88.63 7.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.048 -0.524 . . . . 65.02 110.713 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -104.6 155.14 37.85 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 72.41 110.763 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.643 ' HB2' HG21 ' A' ' 166' ' ' VAL . 51.6 Cg_endo -69.49 125.55 12.41 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.433 2.089 . . . . 54.22 112.436 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -95.46 152.29 18.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.007 -0.542 . . . . 63.52 110.9 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.99 116.95 3.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.278 -0.419 . . . . 51.23 110.981 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 100.59 -26.99 22.52 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.73 -0.748 . . . . 75.33 112.519 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -73.13 137.62 45.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.835 0.35 . . . . 53.12 110.905 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.679 HG23 ' HG3' ' A' ' 165' ' ' LYS . 1.2 t -71.16 163.65 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 74.14 110.944 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.728 HG22 ' O ' ' A' ' 164' ' ' PHE . 2.8 m -153.77 145.27 14.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.038 -0.528 . . . . 73.13 110.884 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.449 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.3 OUTLIER -127.18 117.72 22.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.708 0.289 . . . . 75.13 110.658 179.591 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.738 ' HB3' HD22 ' A' ' 220' ' ' LEU . 28.4 p -153.23 167.64 28.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.965 0.412 . . . . 52.23 111.15 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.629 ' O ' HG13 ' A' ' 218' ' ' VAL . 8.4 m95 -102.64 162.98 12.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.928 -0.578 . . . . 73.22 110.067 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.673 ' CE1' HD13 ' A' ' 162' ' ' LEU . 46.3 p90 -162.3 138.4 7.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.078 0.466 . . . . 74.34 111.667 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.85 HG23 ' OG1' ' A' ' 147' ' ' THR . 0.2 OUTLIER -127.49 112.64 15.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.674 -0.694 . . . . 63.4 110.477 179.674 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.608 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.5 143.7 16.87 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.619 -0.801 . . . . 60.02 113.001 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.621 HG23 ' CG1' ' A' ' 144' ' ' VAL . 0.1 OUTLIER -151.47 139.01 19.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.758 0.313 . . . . 73.54 110.539 179.653 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.744 HD21 HG23 ' A' ' 208' ' ' ILE . 70.8 mt -72.0 -178.58 2.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.288 -0.415 . . . . 63.33 111.031 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -58.3 -42.32 86.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 71.24 110.752 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.87 -4.41 40.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.927 -0.579 . . . . 73.04 111.418 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . 0.583 ' C ' HG22 ' A' ' 138' ' ' THR . . . 90.68 21.73 36.04 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.674 -0.774 . . . . 72.14 112.726 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -90.66 109.12 20.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.8 0.333 . . . . 51.02 110.686 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.621 ' CG1' HG23 ' A' ' 138' ' ' THR . 3.1 m -63.58 139.93 20.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 44.32 111.165 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 33.7 p90 -118.85 -40.53 2.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.055 -0.52 . . . . 64.04 111.071 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -155.17 119.98 4.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.074 -0.512 . . . . 61.54 110.727 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.85 ' OG1' HG23 ' A' ' 136' ' ' THR . 3.5 t -142.82 129.39 20.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.279 -0.419 . . . . 73.44 111.327 -179.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.483 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 26.3 t30 -93.62 46.65 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 72.41 110.435 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.551 HD13 ' HB3' ' A' ' 134' ' ' TRP . 17.6 mm . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 115.923 -0.581 . . . . 62.21 110.905 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.616 ' HB1' ' HH2' ' A' ' 134' ' ' TRP . . . . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.807 0.337 . . . . 50.41 111.129 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 5.7 tttm -138.69 120.36 10.26 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 74.21 110.863 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . 0.418 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 43.7 Cg_exo -56.33 150.96 47.11 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.378 2.052 . . . . 64.03 112.28 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.673 HD13 ' CE1' ' A' ' 135' ' ' TYR . 5.5 tt -74.17 121.73 21.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 63.03 110.563 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.563 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.1 OUTLIER -99.29 120.36 39.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.94 0.4 . . . . 72.23 111.11 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.728 ' O ' HG22 ' A' ' 131' ' ' VAL . 6.4 p90 -148.47 140.66 24.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.045 -0.525 . . . . 65.53 110.455 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.679 ' HG3' HG23 ' A' ' 130' ' ' VAL . 82.3 mttt -80.19 139.1 36.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.066 0.46 . . . . 74.22 111.192 -179.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.643 HG21 ' HB2' ' A' ' 125' ' ' PRO . 34.8 m -87.77 149.17 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.738 -0.664 . . . . 73.13 111.16 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.53 21.92 78.68 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.831 -0.7 . . . . 65.0 112.822 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.751 HG23 ' HG3' ' A' ' 170' ' ' LYS . 16.0 m -128.0 41.68 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.881 0.372 . . . . 74.21 111.18 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 41.21 38.19 1.8 Allowed Glycine 0 C--N 1.332 0.356 0 CA-C-N 115.975 -0.557 . . . . 71.15 113.403 179.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . 0.751 ' HG3' HG23 ' A' ' 168' ' ' VAL . 6.8 mtpp -87.38 -39.95 14.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.807 0.337 . . . . 44.42 111.077 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.5 m -119.03 177.13 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.205 -0.452 . . . . 75.12 110.925 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.531 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.42 158.6 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.339 -0.391 . . . . 73.13 111.331 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -67.34 -26.75 66.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.096 -0.502 . . . . 65.12 111.072 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.46 -37.07 36.77 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.615 -0.802 . . . . 73.12 112.087 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.668 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.5 t90 -78.2 -33.72 49.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.965 0.412 . . . . 75.32 111.044 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . 0.484 ' O ' HD13 ' A' ' 180' ' ' LEU . 4.3 t70 -64.65 -36.56 84.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.99 -0.55 . . . . 74.11 110.525 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -75.5 -29.58 59.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.025 -0.534 . . . . 73.4 110.648 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.672 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -81.46 -46.5 14.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 63.13 111.125 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.577 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 10.6 mt -70.67 -18.97 62.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.977 -0.556 . . . . 73.24 111.117 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.484 HD13 ' O ' ' A' ' 176' ' ' ASP . 2.2 tp -55.31 -23.06 21.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.453 -0.34 . . . . 72.13 111.453 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 27.0 p -115.95 19.92 14.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.588 -0.278 . . . . 71.03 111.565 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 2.2 mmt -66.17 108.15 2.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.843 0.354 . . . . 71.43 110.89 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.78 145.23 43.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 73.53 110.853 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.67 115.53 2.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 73.3 111.191 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 76.61 21.88 73.8 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.967 -0.635 . . . . 73.33 113.002 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -98.38 144.56 27.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.875 0.369 . . . . 71.33 111.201 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 10.6 ttpt -117.1 139.09 51.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.04 -0.527 . . . . 73.22 110.077 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.64 174.34 11.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.177 0.513 . . . . 62.11 112.0 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.54 107.35 6.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.478 -0.783 . . . . 74.31 109.701 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.672 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.0 OUTLIER -120.16 142.06 49.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.184 0.516 . . . . 63.03 112.105 -178.855 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.629 ' HG3' HG23 ' A' ' 215' ' ' THR . 0.3 OUTLIER -114.32 119.72 37.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.54 -0.755 . . . . 73.11 110.112 179.272 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.521 ' N ' HD13 ' A' ' 192' ' ' ILE . 0.9 OUTLIER -98.26 151.29 4.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.911 0.386 . . . . 74.31 111.173 -179.593 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -86.76 165.14 34.0 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.518 . . . . 63.31 110.715 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -62.12 -42.19 31.0 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.492 2.128 . . . . 73.12 112.246 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -59.0 -39.0 80.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.265 -0.425 . . . . 63.14 111.066 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.442 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 8.9 m0 -97.6 36.94 1.43 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.324 -0.398 . . . . 65.21 110.985 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -162.75 -77.55 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.444 . . . . 44.1 110.749 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . 0.746 ' CE2' HD13 ' A' ' 208' ' ' ILE . 23.0 m-85 -105.12 -71.22 0.75 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 72.0 110.516 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.21 175.46 14.1 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.873 -0.68 . . . . 62.4 112.845 179.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -26.38 63.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.782 0.325 . . . . 74.44 110.983 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -67.43 -52.61 37.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.976 0.417 . . . . 71.22 110.776 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 102.33 168.33 26.79 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.87 -0.681 . . . . 73.51 112.515 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.509 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.5 OUTLIER -107.43 91.63 7.26 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.657 0.265 . . . . 73.11 110.791 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -66.95 -21.03 50.51 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.462 2.108 . . . . 61.35 112.477 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.05 -42.05 98.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.873 0.368 . . . . 72.21 110.949 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -105.92 31.18 5.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.102 -0.499 . . . . 72.32 111.15 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 30.9 mttt 54.33 28.28 9.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 74.02 111.039 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.746 HD13 ' CE2' ' A' ' 198' ' ' TYR . 60.1 mt -89.07 113.55 56.64 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 73.41 110.966 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.26 171.5 11.45 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.447 2.098 . . . . 52.44 112.458 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.44 152.62 70.99 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.606 2.204 . . . . 74.51 112.378 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 46.4 32.14 1.48 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.19 -0.459 . . . . 74.41 111.228 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -79.9 144.29 33.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 63.51 111.483 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . 0.619 ' O ' HD23 ' A' ' 214' ' ' LEU . 18.5 tttt -89.55 144.72 25.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.938 -0.574 . . . . 74.31 110.258 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.631 HD11 ' CE2' ' A' ' 198' ' ' TYR . 8.0 mt -127.0 108.88 11.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.876 0.369 . . . . 62.41 111.7 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.629 HG23 ' HG3' ' A' ' 191' ' ' GLU . 56.2 m -109.67 143.18 39.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 52.43 110.501 179.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.608 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 15.0 p90 -156.05 178.38 10.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.108 0.48 . . . . 65.22 111.336 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -134.3 137.71 44.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.667 -0.697 . . . . 71.32 110.314 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.668 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.1 t -123.71 151.95 28.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.018 0.437 . . . . 73.04 111.876 -178.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -136.74 110.42 8.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.793 -0.639 . . . . 74.45 110.27 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.738 HD22 ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.47 132.81 46.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.426 -0.352 . . . . 74.44 110.758 -179.584 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.499 HG21 ' HE1' ' A' ' 134' ' ' TRP . 20.6 t -111.11 -31.45 2.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.279 -0.419 . . . . 64.42 111.469 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -170.66 161.97 7.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.904 0.383 . . . . 63.13 110.983 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.546 HG23 HG12 ' A' ' 131' ' ' VAL . 4.2 mp -139.48 109.61 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 72.55 111.058 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 75.0 110.906 179.977 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.849 HG11 HG21 ' A' ' 136' ' ' THR . 57.3 t . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.607 0.241 . . . . 65.11 111.062 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.457 ' HA ' ' HG2' ' A' ' 217' ' ' GLU . 98.3 Cg_endo -85.92 149.78 9.65 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 123.007 2.471 . . . . 71.13 112.552 -179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.443 ' NE2' HD11 ' A' ' 149' ' ' ILE . 0.8 OUTLIER -84.43 147.2 27.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 43.21 110.972 -179.953 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.28 99.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 73.31 111.234 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.42 -18.35 61.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 51.34 111.268 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.431 ' CH2' ' HB3' ' A' ' 24' ' ' ASP . 2.2 m-90 -131.81 173.35 11.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.865 0.364 . . . . 71.04 110.737 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.74 153.64 27.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.108 -0.496 . . . . 74.44 110.452 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.613 HG12 ' HD2' ' A' ' 16' ' ' ARG . 33.6 t -54.75 -35.01 31.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.983 0.42 . . . . 75.45 110.817 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.44 -34.32 78.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.985 -0.552 . . . . 64.12 111.069 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.457 ' HG2' HD12 ' A' ' 20' ' ' LEU . 0.8 OUTLIER -78.5 -55.43 5.22 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.798 0.332 . . . . 73.24 111.044 -179.902 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.709 ' HB3' HG22 ' A' ' 60' ' ' VAL . 8.2 mt -50.7 -30.76 14.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.993 0.425 . . . . 74.04 110.855 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.613 ' HD2' HG12 ' A' ' 12' ' ' VAL . 47.7 mtt180 -90.95 -28.77 17.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.829 -0.623 . . . . 75.31 110.397 179.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 31.0 t -49.37 176.0 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.901 -0.591 . . . . 74.24 111.484 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -110.37 17.41 20.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.746 -0.661 . . . . 74.41 111.234 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -117.67 -16.45 10.06 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.63 -0.259 . . . . 75.51 111.495 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.457 HD12 ' HG2' ' A' ' 14' ' ' GLN . 2.1 tt -87.72 112.49 49.07 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-O 120.55 0.214 . . . . 74.43 111.028 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.09 125.35 17.87 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.478 2.119 . . . . 61.13 112.182 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -24.23 62.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.444 . . . . 63.52 111.161 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -55.07 -43.64 74.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.366 -0.379 . . . . 73.53 111.474 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.431 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 1.5 m-20 -69.32 -54.8 12.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.27 -0.423 . . . . 74.51 111.202 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 41.1 mt -46.36 -33.25 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.929 -0.578 . . . . 62.25 111.422 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.549 HG12 HD22 ' A' ' 59' ' ' LEU . 8.2 mt -77.78 -38.03 24.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.315 -0.402 . . . . 70.33 111.033 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -67.11 -23.15 65.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.11 -0.495 . . . . 74.34 111.102 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -77.37 -49.8 14.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.036 0.446 . . . . 74.45 110.92 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 1.054 HD23 HD12 ' A' ' 66' ' ' LEU . 6.5 mt -61.77 -21.42 64.54 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.747 -0.661 . . . . 73.41 111.185 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.503 ' HA ' HD11 ' A' ' 38' ' ' LEU . 72.2 mt-30 -81.5 -58.72 2.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.99 0.424 . . . . 72.3 110.945 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -63.72 -37.45 87.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.844 -0.616 . . . . 75.34 111.746 -179.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.425 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 14.4 m170 -94.57 -7.9 39.75 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.764 0.283 . . . . 72.3 111.764 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.46 162.28 12.97 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.581 -0.819 . . . . 53.31 112.419 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.6 p -91.79 148.46 22.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.532 0.206 . . . . 53.3 110.524 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.732 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.7 OUTLIER -48.98 -57.08 7.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.803 0.335 . . . . 74.05 111.136 -179.729 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.8 t -48.1 -50.33 28.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.018 0.437 . . . . 61.31 110.772 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.537 ' CD1' ' HB2' ' A' ' 71' ' ' ARG . 15.9 t80 -54.09 -47.66 71.51 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.804 -0.635 . . . . 72.04 110.468 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.7 HD21 ' O ' ' A' ' 29' ' ' LEU . 13.5 mt -64.88 -41.7 95.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.944 -0.571 . . . . 71.43 110.754 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.811 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.85 -42.18 25.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.09 0.471 . . . . 73.05 110.889 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -60.53 -28.09 68.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.686 -0.688 . . . . 64.14 110.883 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 -112.56 10.02 19.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.221 -0.445 . . . . 73.13 111.131 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.91 36.2 17.72 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.801 0.334 . . . . 61.41 110.987 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.793 HD13 HD13 ' A' ' 29' ' ' LEU . 15.6 mt -95.86 -19.79 19.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 74.44 111.756 -179.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.811 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -77.13 159.66 29.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.077 0.465 . . . . 65.41 111.071 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.05 -122.22 5.56 Favored Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 115.706 -0.679 . . . . 74.0 112.367 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.782 ' O ' HG23 ' A' ' 50' ' ' VAL . 14.5 m120 -116.39 119.19 34.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.784 0.326 . . . . 73.43 110.925 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.535 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -46.07 -52.84 2.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.205 -0.452 . . . . 60.22 111.33 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -48.06 -36.96 13.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.914 -0.585 . . . . 70.11 110.742 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -85.61 -26.1 26.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.874 -0.603 . . . . 74.04 110.884 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.782 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.6 t -79.99 -25.97 11.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.289 -0.414 . . . . 72.41 111.331 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.33 -23.75 67.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.386 -0.37 . . . . 73.34 111.102 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -95.28 -28.62 14.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.246 -0.434 . . . . 71.43 110.883 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.5 m -101.99 33.7 2.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 61.42 110.92 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -162.45 126.45 3.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 64.24 110.944 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.72 168.12 14.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.474 . . . . 72.02 110.704 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.543 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -52.77 -58.11 7.93 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.896 0.379 . . . . 74.31 110.505 179.866 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.66 -28.56 65.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.144 -0.48 . . . . 74.15 110.187 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.48 96.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.897 -0.592 . . . . 73.3 110.264 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.592 HD23 HD21 ' A' ' 43' ' ' LEU . 8.6 mt -73.41 -32.0 64.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.564 -0.744 . . . . 72.1 110.977 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.709 HG22 ' HB3' ' A' ' 15' ' ' LEU . 33.9 t -78.4 -42.86 26.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.323 -0.399 . . . . 61.21 111.022 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.7 m -60.56 -33.99 73.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.023 -0.535 . . . . 50.24 110.521 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.462 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -82.04 -22.7 36.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.046 -0.524 . . . . 74.14 110.954 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.821 ' HA ' HD21 ' A' ' 29' ' ' LEU . 38.9 t80 -83.83 -22.81 31.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.142 -0.481 . . . . 74.54 110.989 179.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -84.15 -54.28 4.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 73.43 111.219 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.462 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 2.0 p-80 -62.94 -26.22 68.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.987 -0.551 . . . . 74.11 111.18 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 1.054 HD12 HD23 ' A' ' 29' ' ' LEU . 3.0 tt -48.94 -42.83 38.65 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.951 0.405 . . . . 43.31 110.91 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -79.02 -39.03 35.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.859 -0.609 . . . . 75.4 110.499 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.02 -45.13 96.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.951 -0.568 . . . . 75.51 110.685 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.5 p -89.89 -4.58 57.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.903 -0.589 . . . . 74.42 111.373 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.47 36.46 16.85 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.797 0.332 . . . . 72.24 111.24 179.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.537 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 7.3 mmt180 -88.58 46.05 1.35 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.246 -0.434 . . . . 72.22 111.517 -179.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.468 ' CE1' HD22 ' A' ' 66' ' ' LEU . 93.3 m-85 -68.17 173.22 4.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.8 0.333 . . . . 75.43 110.791 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 69.8 tttt . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.28 -0.418 . . . . 64.33 110.899 179.922 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.438 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 4.1 mttt . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.75 0.309 . . . . 74.3 110.945 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.453 ' CE2' ' HB2' ' A' ' 178' ' ' ALA . 39.4 p90 -153.79 160.68 42.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.279 -0.419 . . . . 73.01 110.91 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 79.9 m -128.93 103.5 7.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.132 -0.485 . . . . 74.14 110.897 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.404 ' HG2' ' N ' ' A' ' 114' ' ' SER . 5.3 tttt -103.14 144.27 31.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.317 -0.401 . . . . 70.32 111.045 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.498 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -139.44 120.36 14.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.161 -0.472 . . . . 73.25 110.905 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 30.6 t -75.36 106.36 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 74.25 111.288 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.498 HD22 ' O ' ' A' ' 114' ' ' SER . 3.9 mm? -80.75 -44.77 18.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 73.4 110.844 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -123.34 107.84 12.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.441 . . . . 75.11 111.049 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.5 mttm -62.44 139.58 58.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 71.22 110.803 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -106.66 -106.27 3.1 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.759 -0.734 . . . . 53.23 112.452 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -90.48 -43.8 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.965 0.412 . . . . 73.04 110.745 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.458 ' O ' HG23 ' A' ' 122' ' ' THR . 0.3 OUTLIER 72.26 38.92 0.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.918 -0.583 . . . . 73.4 110.763 -179.796 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.458 HG23 ' O ' ' A' ' 121' ' ' LYS . 0.8 OUTLIER -160.59 -44.76 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.007 -0.542 . . . . 64.22 110.785 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -85.17 106.32 16.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 75.23 110.873 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.4 ' CD1' ' O ' ' A' ' 122' ' ' THR . 18.2 m-85 -119.22 147.78 43.7 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.186 -0.461 . . . . 72.24 110.885 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.567 ' CB ' HG11 ' A' ' 166' ' ' VAL . 52.0 Cg_exo -54.33 127.99 28.19 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.579 2.186 . . . . 43.53 112.303 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.0 mmtm -103.21 147.35 27.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 75.51 110.882 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 11.5 mtpt -55.64 111.25 0.86 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 73.21 111.02 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 107.42 -16.37 37.98 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.759 -0.734 . . . . 74.11 112.693 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.76 136.78 32.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.803 0.335 . . . . 74.12 110.875 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.705 HG12 ' HG3' ' A' ' 165' ' ' LYS . 23.9 m -70.82 171.88 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.253 -0.43 . . . . 73.33 111.302 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.874 HG22 ' O ' ' A' ' 164' ' ' PHE . 19.9 m -156.63 145.47 11.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.773 -0.649 . . . . 75.34 110.529 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.451 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.2 117.83 23.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.683 0.278 . . . . 72.2 110.755 179.865 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.552 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.4 p -155.16 169.58 23.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.976 0.417 . . . . 74.33 111.216 -179.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.621 ' HB3' HD13 ' A' ' 149' ' ' ILE . 12.3 m95 -106.36 165.62 11.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.858 -0.61 . . . . 71.13 110.074 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.483 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 39.9 p90 -161.76 136.21 6.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.041 0.448 . . . . 71.54 111.837 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.849 HG21 HG11 ' A' ' 5' ' ' VAL . 1.9 m -122.77 108.8 13.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.728 -0.669 . . . . 73.32 110.19 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.672 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.15 146.02 18.11 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.573 -0.823 . . . . 75.23 113.55 -179.128 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.583 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -152.28 152.53 32.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.767 0.318 . . . . 70.32 110.575 179.771 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.885 HD21 HD12 ' A' ' 208' ' ' ILE . 14.5 mt -87.52 -177.51 5.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 74.44 110.972 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -56.87 -43.44 81.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.103 -0.498 . . . . 65.42 110.939 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.1 -9.77 59.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.997 -0.547 . . . . 71.22 111.249 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 100.91 25.83 8.26 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.669 -0.777 . . . . 62.41 112.52 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.14 108.73 17.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.775 0.321 . . . . 42.4 110.864 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.483 HG22 HG23 ' A' ' 138' ' ' THR . 39.0 t -63.67 126.4 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 74.43 111.111 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.682 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 51.7 p90 -111.83 -28.63 7.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 75.32 111.106 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -158.47 115.16 2.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.892 0.377 . . . . 74.33 111.084 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.674 HG23 HG23 ' A' ' 136' ' ' THR . 85.5 m -132.9 106.75 7.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 51.22 110.83 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.483 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 36.0 t30 -86.33 6.7 28.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.446 . . . . 72.24 111.552 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.621 HD13 ' HB3' ' A' ' 134' ' ' TRP . 12.4 mm . . . . . 0 C--N 1.33 -0.24 0 CA-C-O 120.682 0.277 . . . . 72.41 110.661 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.428 ' HB1' ' CH2' ' A' ' 134' ' ' TRP . . . . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.819 0.342 . . . . 61.12 110.994 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -132.09 121.62 17.86 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 74.24 110.855 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . 0.416 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 51.9 Cg_exo -54.67 150.7 34.72 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.396 2.064 . . . . 63.43 112.259 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 3.3 tt -77.89 121.13 23.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.217 -0.447 . . . . 75.25 110.49 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.652 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -99.25 121.73 41.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.945 0.402 . . . . 75.13 111.402 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.874 ' O ' HG22 ' A' ' 131' ' ' VAL . 14.7 p90 -149.25 141.02 23.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.989 -0.55 . . . . 74.32 110.652 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.705 ' HG3' HG12 ' A' ' 130' ' ' VAL . 36.2 mttp -78.07 138.04 38.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.988 0.423 . . . . 64.41 111.151 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.567 HG11 ' CB ' ' A' ' 125' ' ' PRO . 35.8 m -87.76 149.12 4.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.84 -0.618 . . . . 63.35 111.157 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.25 24.61 74.81 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.783 -0.723 . . . . 60.21 112.635 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.734 HG23 ' HG2' ' A' ' 170' ' ' LYS . 5.6 m -132.94 43.26 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.867 0.365 . . . . 73.32 111.037 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.2 36.38 5.41 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 121.151 -0.547 . . . . 73.41 113.168 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . 0.734 ' HG2' HG23 ' A' ' 168' ' ' VAL . 2.7 mmtm -82.47 -47.06 12.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.899 0.38 . . . . 75.3 110.997 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -119.07 -179.33 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.06 -0.518 . . . . 72.53 110.962 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.572 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -58.41 160.69 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.375 -0.375 . . . . 74.03 111.265 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -68.95 -27.91 66.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.198 -0.455 . . . . 73.05 111.259 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . 0.411 ' HA2' ' CE3' ' A' ' 196' ' ' TRP . . . -75.21 -37.46 42.37 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.595 -0.812 . . . . 53.14 111.98 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.691 ' CD1' HD11 ' A' ' 190' ' ' LEU . 1.8 t90 -77.86 -33.15 52.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.985 0.421 . . . . 60.44 111.033 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -63.22 -38.58 91.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.962 -0.563 . . . . 61.01 110.636 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . 0.429 ' O ' HG23 ' A' ' 181' ' ' THR . 2.8 mm-40 -75.5 -29.37 59.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.988 -0.551 . . . . 42.21 110.824 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.662 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -79.13 -61.94 1.85 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.436 . . . . 63.31 111.32 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.789 HD21 HG21 ' A' ' 218' ' ' VAL . 6.9 mt -53.77 -33.77 56.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.028 -0.533 . . . . 75.14 111.031 -179.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 49.3 tp -58.84 -28.17 65.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.368 -0.378 . . . . 74.31 110.825 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . 0.429 HG23 ' O ' ' A' ' 177' ' ' GLU . 26.4 p -91.75 -2.96 56.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 71.3 111.404 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 1.1 ttp -77.7 156.63 30.55 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.79 0.329 . . . . 74.13 110.797 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -112.79 167.96 10.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 65.44 111.134 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . 0.442 ' HA ' HD22 ' A' ' 220' ' ' LEU . 3.9 tttp -68.16 126.48 29.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.961 -0.563 . . . . 72.41 111.034 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.67 33.14 71.16 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.759 -0.734 . . . . 63.02 112.683 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -118.34 148.76 42.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.793 0.33 . . . . 64.02 110.849 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -117.09 139.75 50.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.297 -0.411 . . . . 74.01 110.213 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -145.65 173.86 11.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.151 0.5 . . . . 74.42 111.866 -179.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.75 114.93 10.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.585 -0.734 . . . . 63.25 109.71 179.183 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.691 HD11 ' CD1' ' A' ' 175' ' ' TRP . 0.9 OUTLIER -126.11 141.87 51.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.501 . . . . 55.53 112.131 -178.948 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.565 ' HG3' HG23 ' A' ' 215' ' ' THR . 0.2 OUTLIER -116.76 112.89 21.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.556 -0.747 . . . . 71.1 110.236 179.345 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.466 HD11 ' CZ ' ' A' ' 216' ' ' PHE . 3.7 mp -101.09 143.48 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.971 0.415 . . . . 75.42 111.637 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.42 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.1 mt-10 -79.99 167.71 31.54 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 73.41 110.59 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . 0.42 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 18.8 Cg_endo -60.36 -44.03 30.55 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.45 2.1 . . . . 62.25 112.257 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.03 -25.27 11.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 73.23 111.296 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.438 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 7.4 m0 -118.02 36.95 4.13 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.472 -0.331 . . . . 53.22 111.097 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -155.25 -83.59 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 61.04 111.357 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . 0.491 ' HD2' HG21 ' A' ' 208' ' ' ILE . 35.6 m-85 -105.59 -27.91 11.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.898 0.38 . . . . 75.15 110.84 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 105.38 176.8 24.22 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.832 -0.699 . . . . 74.2 112.789 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -60.23 -34.65 73.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.79 0.328 . . . . 75.53 110.858 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -49.49 77.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 73.24 110.707 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.34 -158.65 14.21 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.839 -0.696 . . . . 52.44 112.605 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.451 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.0 OUTLIER -149.77 83.64 6.23 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 120.82 0.343 . . . . 63.14 110.518 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.39 -43.6 43.35 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.725 2.284 . . . . 73.51 112.727 -179.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.64 -42.13 70.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.889 0.376 . . . . 71.44 111.036 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.682 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -96.95 26.73 4.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.043 -0.526 . . . . 63.42 111.299 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.19 31.13 4.8 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.405 -0.361 . . . . 72.24 111.091 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.885 HD12 HD21 ' A' ' 139' ' ' LEU . 18.5 mm -95.72 111.72 56.71 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 74.22 111.19 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.29 161.3 43.19 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.407 2.071 . . . . 62.22 112.214 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_exo -51.62 118.62 4.6 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.489 2.126 . . . . 64.31 112.292 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 65.07 72.5 0.43 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.226 -0.443 . . . . 62.1 110.849 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -122.33 151.64 40.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 72.34 111.256 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . 0.523 ' O ' HD23 ' A' ' 214' ' ' LEU . 5.6 tptt -88.7 148.12 24.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.074 -0.512 . . . . 74.2 110.45 179.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.523 HD23 ' O ' ' A' ' 213' ' ' LYS . 8.2 mt -129.86 109.41 10.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.839 0.352 . . . . 73.34 111.363 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.565 HG23 ' HG3' ' A' ' 191' ' ' GLU . 58.5 m -106.97 138.92 42.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.062 -0.517 . . . . 71.31 110.786 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.672 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 9.0 p90 -161.8 -175.4 4.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.265 -0.425 . . . . 64.1 111.053 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . 0.457 ' HG2' ' HA ' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -144.65 147.96 33.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 73.32 110.807 -179.946 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.789 HG21 HD21 ' A' ' 179' ' ' LEU . 1.5 t -125.89 153.36 33.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.98 -0.555 . . . . 71.13 112.025 -178.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -133.93 106.11 7.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.846 -0.615 . . . . 74.54 110.031 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.621 HD21 ' CG1' ' A' ' 223' ' ' ILE . 1.3 tt -69.93 130.97 43.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.406 -0.361 . . . . 55.31 110.996 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 28.1 t -109.3 -29.72 2.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.17 -0.468 . . . . 74.55 111.466 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . 0.408 ' N ' HD23 ' A' ' 220' ' ' LEU . 4.0 t0 -171.11 161.67 6.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.869 0.366 . . . . 74.2 111.267 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.678 HG23 HG12 ' A' ' 131' ' ' VAL . 39.3 mt -141.96 111.45 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.087 -0.506 . . . . 74.04 110.99 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 74.4 110.899 179.979 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 1.033 HG11 HG21 ' A' ' 136' ' ' THR . 60.1 t . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.653 0.263 . . . . 73.14 111.063 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.446 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 72.0 Cg_endo -77.18 137.75 17.38 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.708 2.272 . . . . 75.21 112.456 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -82.35 148.1 28.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 72.44 110.76 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.89 97.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 71.34 111.207 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.95 -16.36 63.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.482 . . . . 51.41 111.397 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.451 ' CZ3' ' HA ' ' A' ' 25' ' ' ILE . 4.1 m-90 -129.44 161.87 29.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.948 0.404 . . . . 70.41 110.812 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.5 m -100.48 150.02 23.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.873 -0.603 . . . . 71.3 110.148 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.485 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 46.3 t -56.85 -36.84 51.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.958 0.409 . . . . 62.24 110.47 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.411 ' O ' ' HB2' ' A' ' 17' ' ' SER . 3.7 pt-20 -69.1 -22.71 63.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.814 -0.63 . . . . 55.25 110.852 179.366 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.434 ' O ' ' HB2' ' A' ' 17' ' ' SER . 26.0 mt-30 -82.03 -54.49 5.26 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.358 -0.383 . . . . 75.53 111.174 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.8 ' HB3' HG22 ' A' ' 60' ' ' VAL . 7.1 mt -50.11 -66.38 0.4 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 60.3 111.782 -179.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.485 ' HG2' ' O ' ' A' ' 12' ' ' VAL . 2.5 ptm180 -59.4 -25.23 64.12 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 120.957 -0.297 . . . . 74.44 111.242 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.434 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -52.03 179.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.919 0.39 . . . . 55.33 111.144 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -110.36 16.43 21.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.055 -0.521 . . . . 73.32 111.199 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.85 -23.75 8.48 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.497 -0.32 . . . . 74.42 111.184 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.918 HD12 HD11 ' A' ' 25' ' ' ILE . 1.2 tm? -80.67 117.2 66.78 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.454 -0.339 . . . . 74.12 110.856 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.546 ' HD2' HD22 ' A' ' 20' ' ' LEU . 37.3 Cg_endo -65.85 123.65 11.62 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.466 2.11 . . . . 72.22 112.425 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -27.82 69.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.112 -0.495 . . . . 62.23 111.278 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.462 ' HA ' HD12 ' A' ' 26' ' ' ILE . 3.0 ttpt -53.47 -39.51 64.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.909 0.385 . . . . 75.42 111.122 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.53 -53.65 9.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.059 -0.519 . . . . 41.25 110.658 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.918 HD11 HD12 ' A' ' 20' ' ' LEU . 36.2 mt -45.63 -33.63 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.799 -0.637 . . . . 71.01 111.342 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.747 ' HB ' HG23 ' A' ' 47' ' ' ILE . 6.0 mt -76.02 -40.21 37.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 61.02 111.037 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -69.43 -23.53 63.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.03 -0.532 . . . . 73.15 111.263 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.451 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 22.9 t80 -74.84 -46.4 36.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.964 0.411 . . . . 75.52 111.124 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.792 HD21 ' HA ' ' A' ' 63' ' ' TYR . 4.5 mt -69.03 -24.67 64.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.963 -0.562 . . . . 74.51 111.185 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.594 ' HA ' HD11 ' A' ' 38' ' ' LEU . 74.6 mt-30 -80.2 -28.37 38.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.387 -0.37 . . . . 73.14 110.98 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -94.29 -41.06 9.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.297 -0.41 . . . . 64.31 111.113 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.451 ' ND1' ' CZ ' ' A' ' 28' ' ' PHE . 11.7 m170 -90.3 -7.32 53.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.301 -0.408 . . . . 75.35 111.477 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.8 164.83 12.99 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.698 -0.763 . . . . 53.22 112.401 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.3 p -92.43 148.39 22.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.671 0.272 . . . . 74.25 110.614 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.604 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.5 OUTLIER -48.66 -57.08 6.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.785 0.326 . . . . 72.24 111.012 -179.804 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.65 -50.72 31.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 74.24 110.706 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.511 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 19.8 t80 -53.78 -47.97 70.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.751 -0.659 . . . . 72.2 110.287 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.712 HD21 ' O ' ' A' ' 29' ' ' LEU . 14.9 mt -63.83 -41.57 97.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.901 -0.591 . . . . 73.22 110.763 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.775 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.55 -40.21 18.35 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.2 -0.455 . . . . 71.45 111.095 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.41 ' HB3' ' CD2' ' A' ' 41' ' ' HIS . 1.7 mt-10 -48.59 -48.78 38.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.864 -0.607 . . . . 64.43 110.972 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.41 ' CD2' ' HB3' ' A' ' 40' ' ' GLU . 5.9 m-70 -103.45 13.64 33.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 75.12 111.223 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 58.17 43.38 20.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.837 0.351 . . . . 64.15 110.894 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.735 HD13 HD13 ' A' ' 29' ' ' LEU . 20.4 mt -95.22 -20.91 18.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 70.02 111.615 -179.593 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.775 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -75.97 158.32 32.1 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.007 0.432 . . . . 44.41 111.127 -179.924 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.76 -124.23 6.1 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.978 -0.629 . . . . 73.44 112.42 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.894 ' O ' HG23 ' A' ' 50' ' ' VAL . 3.7 m120 -116.3 121.18 41.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.783 0.325 . . . . 74.01 110.945 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.747 HG23 ' HB ' ' A' ' 26' ' ' ILE . 2.4 mp -46.76 -50.53 5.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.223 -0.444 . . . . 55.54 111.335 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mttm -50.41 -38.64 43.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.923 -0.581 . . . . 73.54 110.753 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -85.57 -26.3 26.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.881 -0.599 . . . . 64.41 110.9 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.894 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.0 t -79.2 -26.22 12.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.28 -0.418 . . . . 74.22 111.313 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.01 -23.34 67.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.399 -0.364 . . . . 74.23 111.123 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -95.22 -28.06 15.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 61.45 110.9 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.02 33.64 2.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 72.4 110.918 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -159.54 124.51 4.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 13.42 110.962 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -83.85 171.09 13.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 71.12 110.755 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.777 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -55.27 -57.92 9.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.391 . . . . 75.21 110.599 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.32 -26.19 67.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.985 -0.552 . . . . 63.35 110.435 179.338 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -45.18 93.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.995 -0.548 . . . . 65.3 110.492 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.641 HD21 HG12 ' A' ' 26' ' ' ILE . 24.6 mt -74.68 -29.14 61.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.695 -0.684 . . . . 73.15 111.101 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.8 HG22 ' HB3' ' A' ' 15' ' ' LEU . 5.9 t -79.71 -43.52 23.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.972 0.415 . . . . 64.24 110.885 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.7 m -61.0 -34.99 75.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.911 -0.586 . . . . 70.54 110.761 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.451 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -81.33 -23.39 37.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 51.1 111.073 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.792 ' HA ' HD21 ' A' ' 29' ' ' LEU . 27.0 t80 -83.74 -22.79 31.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 73.41 110.945 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.1 m-20 -83.42 -54.61 4.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 73.24 111.39 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.511 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.3 p-80 -62.59 -25.79 68.26 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.114 -0.494 . . . . 62.43 111.327 -179.411 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.715 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.0 tt -53.25 -40.07 64.32 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.877 0.37 . . . . 71.41 110.935 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -78.71 -38.93 37.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.029 -0.532 . . . . 73.11 110.621 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.86 -41.26 91.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.023 -0.535 . . . . 73.4 110.772 179.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.9 p -90.85 -4.14 56.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.938 -0.574 . . . . 64.51 111.437 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.98 37.93 11.38 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.735 0.302 . . . . 73.32 111.351 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.425 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 27.0 mtt-85 -94.13 44.1 1.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.383 -0.371 . . . . 63.34 111.092 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.534 ' HA ' HD21 ' A' ' 66' ' ' LEU . 86.0 m-85 -64.32 177.75 0.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 71.23 110.832 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.3 tttt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 63.43 110.913 179.913 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.439 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 1.8 mptt . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.857 0.36 . . . . 74.14 110.957 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.427 ' CE1' ' HB2' ' A' ' 177' ' ' GLU . 34.3 p90 -151.99 152.36 32.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.207 -0.451 . . . . 73.23 110.886 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 62.9 m -124.08 103.62 8.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 62.03 110.947 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt -97.09 151.34 19.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.445 . . . . 75.24 110.834 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.421 ' O ' HD22 ' A' ' 116' ' ' LEU . 1.4 t -148.69 118.62 7.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.248 -0.433 . . . . 72.34 111.018 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 40.7 t -78.62 106.33 9.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.461 . . . . 61.41 111.242 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.527 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -81.8 -41.26 21.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.419 . . . . 73.02 110.7 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 8.2 ttpp -125.51 109.15 12.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 61.45 111.008 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.4 mttp -61.14 139.44 58.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 74.44 110.937 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -97.33 -108.3 2.59 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.802 -0.713 . . . . 65.51 112.478 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -96.42 -37.32 10.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.967 0.413 . . . . 73.51 110.7 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.4 36.87 0.61 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.885 -0.598 . . . . 74.42 110.911 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 58.8 m -163.09 -43.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 71.34 111.086 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -81.81 86.05 6.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.286 -0.416 . . . . 74.32 111.158 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -102.74 143.36 26.45 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 75.42 110.743 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.633 ' HA ' HG21 ' A' ' 223' ' ' ILE . 52.7 Cg_exo -55.51 130.96 43.36 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.559 2.173 . . . . 74.51 112.575 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.12 147.31 24.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 72.11 110.735 179.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -53.3 116.94 2.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.329 -0.396 . . . . 75.52 111.139 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 93.8 -4.27 71.86 Favored Glycine 0 CA--C 1.519 0.326 0 C-N-CA 120.732 -0.747 . . . . 73.52 112.876 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.21 139.5 30.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.869 0.366 . . . . 70.0 110.972 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.613 HG12 ' O ' ' A' ' 224' ' ' ASP . 7.8 p -69.39 162.23 3.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 72.43 111.055 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.92 HG12 HG23 ' A' ' 223' ' ' ILE . 13.4 m -154.86 145.95 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 65.13 111.031 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.463 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -128.08 117.97 22.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.722 0.296 . . . . 74.55 110.951 179.909 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.447 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 22.9 p -151.36 166.76 30.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.92 0.39 . . . . 51.44 111.216 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.652 ' O ' HG13 ' A' ' 218' ' ' VAL . 15.8 m95 -100.93 160.9 13.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.017 -0.538 . . . . 71.43 109.961 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.486 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 17.4 p90 -161.28 138.1 8.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.917 0.389 . . . . 74.31 111.632 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 1.033 HG21 HG11 ' A' ' 5' ' ' VAL . 3.5 m -126.33 109.06 11.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.999 -0.546 . . . . 74.43 111.043 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.724 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -86.94 138.31 15.41 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.834 -0.698 . . . . 73.1 113.111 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.863 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.98 132.56 14.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.705 0.288 . . . . 50.44 110.522 179.547 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.494 HD21 HG23 ' A' ' 208' ' ' ILE . 40.8 mt -70.44 -178.37 1.73 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.381 -0.372 . . . . 74.03 110.991 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -57.15 -42.71 81.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.086 -0.507 . . . . 61.21 110.774 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -76.03 -3.08 33.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.935 -0.575 . . . . 71.12 111.493 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . 0.434 ' O ' HG22 ' A' ' 138' ' ' THR . . . 90.67 8.39 65.63 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.629 -0.796 . . . . 74.2 112.91 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.01 110.01 11.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.785 0.326 . . . . 72.14 110.684 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 137' ' ' GLY . 7.3 p -63.67 133.04 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.289 -0.414 . . . . 54.23 111.158 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.429 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 46.1 p90 -111.22 -29.3 7.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 72.03 110.832 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -168.21 121.8 0.9 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 64.5 110.866 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.674 ' OG1' HG23 ' A' ' 136' ' ' THR . 12.5 t -142.82 128.25 18.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.37 -0.377 . . . . 74.15 111.077 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.486 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 27.3 t30 -89.14 53.29 2.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.096 -0.502 . . . . 65.2 110.631 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . 3.2 mt . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 52.1 111.394 179.964 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.802 0.334 . . . . 22.22 111.116 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 161' ' ' PRO . 23.4 mttm -138.52 134.69 17.54 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 70.11 110.776 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 160' ' ' LYS . 31.1 Cg_exo -58.76 152.18 58.7 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.378 2.052 . . . . 53.32 112.351 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.62 125.56 29.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 70.51 110.306 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.628 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.66 122.91 43.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.991 0.424 . . . . 73.44 111.585 -179.66 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.867 ' O ' HG22 ' A' ' 131' ' ' VAL . 6.6 p90 -151.31 143.62 24.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.859 -0.609 . . . . 74.32 110.516 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.583 ' O ' HG22 ' A' ' 168' ' ' VAL . 34.6 mttt -81.7 142.0 33.08 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 75.33 111.043 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.5 m -87.69 149.03 4.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.897 -0.592 . . . . 73.2 111.285 -179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 67.91 25.11 74.36 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.851 -0.69 . . . . 70.52 112.592 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.608 HG23 ' HG2' ' A' ' 170' ' ' LYS . 27.3 m -131.3 41.11 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.788 0.327 . . . . 73.24 111.174 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.22 35.25 2.49 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 121.194 -0.527 . . . . 72.12 113.151 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . 0.608 ' HG2' HG23 ' A' ' 168' ' ' VAL . 0.0 OUTLIER -83.69 -43.55 15.43 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.794 0.331 . . . . 64.33 111.178 -179.777 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . 0.434 HG22 ' CE2' ' A' ' 164' ' ' PHE . 2.8 m -119.14 179.38 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.166 -0.47 . . . . 61.44 111.147 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.56 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.4 163.61 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 73.41 111.217 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . 0.442 ' HD3' ' CZ2' ' A' ' 196' ' ' TRP . 14.7 ttm105 -70.13 -29.75 66.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.234 -0.439 . . . . 74.3 111.227 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.36 -36.49 49.86 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.603 -0.808 . . . . 74.11 112.02 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.79 ' HE1' HG21 ' A' ' 218' ' ' VAL . 1.7 t90 -79.76 -34.34 39.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.052 0.453 . . . . 73.52 110.874 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . 0.792 ' O ' HD13 ' A' ' 180' ' ' LEU . 14.8 t70 -62.82 -33.28 74.9 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.751 -0.659 . . . . 51.0 110.403 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . 0.427 ' HB2' ' CE1' ' A' ' 111' ' ' TYR . 3.9 mm-40 -80.77 -29.09 36.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.527 . . . . 71.13 110.68 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.504 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -78.8 -61.93 1.86 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.445 . . . . 73.23 111.175 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.712 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 10.1 mt -53.65 -28.14 31.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.967 -0.56 . . . . 55.25 110.794 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.792 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.1 tp -53.38 -29.75 36.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.115 -0.493 . . . . 53.54 111.272 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 60.2 p -108.87 7.7 26.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.382 -0.372 . . . . 64.22 111.7 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.422 ' O ' HD13 ' A' ' 220' ' ' LEU . 26.7 mmm -69.78 106.03 2.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.889 0.376 . . . . 70.33 110.884 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.09 150.25 48.46 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.969 -0.56 . . . . 74.14 111.036 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . 0.71 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -56.12 119.94 6.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.56 . . . . 62.02 110.9 -179.869 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 74.97 20.33 79.5 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.705 -0.76 . . . . 32.23 112.431 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -96.95 143.41 27.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.846 0.355 . . . . 63.23 111.081 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt -110.45 132.9 53.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.061 -0.518 . . . . 74.33 109.787 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -143.08 171.52 13.96 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.235 0.54 . . . . 74.34 112.09 -179.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . 0.449 ' HA ' ' HA ' ' A' ' 217' ' ' GLU . 0.0 OUTLIER -137.09 117.6 13.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.299 -0.864 . . . . 74.22 109.504 179.587 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.923 HD21 ' CE2' ' A' ' 216' ' ' PHE . 2.2 pt? -127.6 141.23 51.68 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.212 -0.595 . . . . 34.41 112.545 -178.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.724 ' HG3' HG23 ' A' ' 215' ' ' THR . 1.4 mp0 -113.59 116.12 29.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.271 -0.877 . . . . 74.24 109.864 179.034 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.425 HG12 ' CE1' ' A' ' 216' ' ' PHE . 4.5 mm -91.42 144.81 8.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.857 0.36 . . . . 60.41 111.372 -179.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -84.47 154.49 62.53 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.069 -0.514 . . . . 74.41 110.481 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . 0.415 ' O ' ' N ' ' A' ' 199' ' ' GLY . 63.7 Cg_exo -51.07 -44.2 43.76 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.458 2.105 . . . . 64.42 112.376 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -62.36 -19.74 63.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 74.02 111.629 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.442 ' CZ2' ' HD3' ' A' ' 173' ' ' ARG . 6.3 m0 -118.55 37.1 4.16 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.64 0.257 . . . . 71.5 111.528 -179.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -156.19 -84.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.634 -0.257 . . . . 74.34 111.581 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . 0.881 ' CE2' HD13 ' A' ' 208' ' ' ILE . 19.6 m-85 -104.96 -26.19 12.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.853 0.359 . . . . 74.41 111.061 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 194' ' ' PRO . . . 105.85 163.33 23.17 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.833 -0.699 . . . . 54.41 112.474 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 28.7 mtmt -55.49 -30.91 61.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.825 0.345 . . . . 75.53 110.824 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 18.8 mtpt -61.21 -48.53 81.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 73.14 110.795 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 106.72 166.32 22.53 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.836 -0.697 . . . . 34.04 112.487 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.841 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.7 OUTLIER -110.68 90.02 10.0 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.701 0.286 . . . . 62.44 110.832 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.17 -21.59 55.21 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.459 2.106 . . . . 73.54 112.409 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.46 -41.6 85.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.318 -0.401 . . . . 64.42 110.923 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -108.11 27.33 9.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.061 -0.518 . . . . 62.32 111.199 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 56.16 54.44 7.82 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.429 . . . . 73.44 111.108 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.881 HD13 ' CE2' ' A' ' 198' ' ' TYR . 27.1 mt -117.35 111.63 39.98 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 74.4 111.06 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . 0.41 ' HA ' ' HD3' ' A' ' 210' ' ' PRO . 38.4 Cg_exo -60.68 157.76 35.84 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.525 2.15 . . . . 55.41 112.373 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 209' ' ' PRO . 31.2 Cg_exo -61.17 130.52 32.67 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.651 2.234 . . . . 75.34 112.142 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 64.09 69.6 0.53 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.337 -0.392 . . . . 54.14 110.873 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -122.87 149.23 44.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.216 -0.447 . . . . 64.3 111.261 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . 0.9 ' O ' HD23 ' A' ' 214' ' ' LEU . 2.3 tttt -83.94 149.77 26.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.03 -0.532 . . . . 74.1 110.554 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.9 HD23 ' O ' ' A' ' 213' ' ' LYS . 7.2 mt -136.19 109.35 7.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.89 0.376 . . . . 54.11 111.576 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.724 HG23 ' HG3' ' A' ' 191' ' ' GLU . 45.7 m -109.95 138.23 46.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 71.14 110.184 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.923 ' CE2' HD21 ' A' ' 190' ' ' LEU . 12.4 p90 -157.79 120.36 3.83 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 112.386 0.513 . . . . 75.52 112.386 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . 0.449 ' HA ' ' HA ' ' A' ' 189' ' ' ARG . 2.6 mt-10 -74.17 136.46 42.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.628 -0.714 . . . . 64.14 110.654 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.79 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.3 t -122.41 150.89 26.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.077 -0.511 . . . . 75.35 111.525 -178.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -136.77 110.18 7.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.039 -0.528 . . . . 54.43 110.491 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.828 HD21 HG13 ' A' ' 223' ' ' ILE . 3.5 tt -70.53 132.16 45.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.404 -0.362 . . . . 74.3 111.145 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.408 HG21 ' HE1' ' A' ' 134' ' ' TRP . 30.8 t -109.68 -30.69 2.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.103 -0.499 . . . . 53.44 111.429 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . 0.423 ' N ' HD23 ' A' ' 220' ' ' LEU . 6.5 t70 -168.94 159.3 9.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.875 0.369 . . . . 75.24 111.107 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.92 HG23 HG12 ' A' ' 131' ' ' VAL . 29.2 mt -142.25 112.01 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 64.2 111.157 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . 0.613 ' O ' HG12 ' A' ' 130' ' ' VAL . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 73.33 110.826 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.954 HG11 HG21 ' A' ' 136' ' ' THR . 40.7 t . . . . . 0 CA--C 1.529 0.151 0 CA-C-O 120.59 0.233 . . . . 65.2 110.84 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.457 ' HB3' ' CE1' ' A' ' 32' ' ' HIS . 93.0 Cg_endo -79.21 135.06 11.88 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.533 2.155 . . . . 74.2 112.46 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -80.31 150.63 29.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.181 -0.463 . . . . 63.23 110.803 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.13 96.03 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.184 -0.462 . . . . 75.42 111.209 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.63 -16.46 64.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 74.13 111.396 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 6.0 m-90 -136.0 173.67 11.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.848 0.356 . . . . 73.34 110.789 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.449 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -116.79 152.11 35.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.113 -0.494 . . . . 74.13 110.597 179.776 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.417 ' CG1' ' HD2' ' A' ' 16' ' ' ARG . 38.2 t -55.88 -32.74 33.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.264 -0.425 . . . . 64.24 110.928 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -72.33 -26.65 62.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.992 -0.549 . . . . 73.25 111.202 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.449 ' HB2' HG23 ' A' ' 11' ' ' THR . 17.3 mt-30 -82.19 -56.44 3.92 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.842 0.353 . . . . 65.32 111.056 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.689 HD13 HG13 ' A' ' 60' ' ' VAL . 1.3 mt -49.58 -65.43 0.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.301 -0.409 . . . . 62.4 111.328 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.558 ' HG3' HG11 ' A' ' 60' ' ' VAL . 4.7 mtp-105 -55.75 -25.09 39.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 73.32 111.356 -179.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.412 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.1 OUTLIER -56.4 -179.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.01 0.434 . . . . 63.15 111.175 -179.799 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -109.41 16.76 22.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.937 -0.574 . . . . 60.41 111.108 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -114.51 -27.86 7.39 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.485 -0.325 . . . . 75.44 111.097 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.899 HD12 HD11 ' A' ' 25' ' ' ILE . 2.5 tm? -81.94 112.61 36.6 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.392 . . . . 53.11 110.954 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -60.66 123.34 12.82 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.52 2.146 . . . . 65.3 112.364 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -24.15 67.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 75.54 111.192 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -53.61 -40.53 65.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.886 0.374 . . . . 75.41 111.232 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.98 -52.5 14.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.092 -0.504 . . . . 71.42 110.728 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.899 HD11 HD12 ' A' ' 20' ' ' LEU . 42.8 mt -44.87 -30.74 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.707 -0.679 . . . . 73.2 111.295 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.795 ' HB ' HG23 ' A' ' 47' ' ' ILE . 7.3 mt -81.76 -55.2 8.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.053 0.454 . . . . 65.44 110.765 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.454 ' HG2' HD11 ' A' ' 47' ' ' ILE . 24.3 mttt -52.44 -27.12 14.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.687 -0.688 . . . . 74.42 110.935 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.454 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 42.7 t80 -77.24 -48.63 17.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.075 -0.511 . . . . 72.3 110.969 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.792 HD21 ' HA ' ' A' ' 63' ' ' TYR . 6.3 mt -67.13 -26.44 66.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.859 -0.609 . . . . 74.23 111.336 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -75.3 -35.66 61.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.942 0.401 . . . . 73.44 110.717 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.424 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 14.9 pt-20 -87.63 -31.19 19.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 70.04 111.075 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.457 ' CE1' ' HB3' ' A' ' 6' ' ' PRO . 19.7 m170 -98.95 -9.02 24.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.289 -0.414 . . . . 75.31 111.571 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -109.86 155.65 15.98 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.719 -0.753 . . . . 63.24 112.318 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.3 p -97.3 153.11 18.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.562 0.22 . . . . 62.31 110.539 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.817 ' HA ' HD12 ' A' ' 38' ' ' LEU . 0.8 OUTLIER -42.89 -48.57 5.84 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.847 0.356 . . . . 72.31 111.371 -179.702 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.6 m -52.85 -50.89 62.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.123 -0.489 . . . . 60.25 110.507 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.759 ' CZ ' HD12 ' A' ' 66' ' ' LEU . 1.1 t80 -60.47 -31.95 70.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.623 -0.717 . . . . 73.33 110.355 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.817 HD12 ' HA ' ' A' ' 35' ' ' ASP . 5.9 mt -75.86 -54.75 6.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.004 -0.543 . . . . 65.24 111.307 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.78 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -50.02 -35.0 23.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.351 -0.386 . . . . 63.55 111.751 -179.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -72.64 -31.13 64.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.242 -0.435 . . . . 65.51 111.523 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 1.8 m170 -109.91 10.33 24.39 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.734 0.272 . . . . 62.52 111.734 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.407 ' N ' ' O ' ' A' ' 38' ' ' LEU . 7.7 mmmt 58.43 35.63 24.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.745 0.307 . . . . 62.12 111.217 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.695 ' CB ' HD23 ' A' ' 38' ' ' LEU . 49.4 mt -90.96 -16.93 27.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.427 -0.352 . . . . 75.31 111.017 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.78 HD11 ' HB2' ' A' ' 39' ' ' ALA . 56.7 mt -50.76 170.46 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.042 0.449 . . . . 61.11 111.32 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.23 -155.94 29.04 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.927 -0.654 . . . . 63.41 112.951 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.887 ' O ' HG23 ' A' ' 50' ' ' VAL . 72.9 m-80 -100.57 141.88 32.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.968 0.413 . . . . 74.14 111.051 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.795 HG23 ' HB ' ' A' ' 26' ' ' ILE . 2.9 mp -45.31 -47.24 3.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.883 -0.598 . . . . 73.11 111.526 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mttm -51.61 -41.58 61.34 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.983 -0.553 . . . . 61.21 111.065 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -85.7 -28.35 24.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.013 -0.54 . . . . 73.33 111.113 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.3 t -74.0 -27.72 22.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.278 -0.419 . . . . 75.52 111.535 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.45 -24.1 67.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.386 -0.37 . . . . 73.43 111.434 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -95.24 -27.3 15.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.341 -0.391 . . . . 71.51 111.28 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.7 m -84.19 -24.38 30.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.362 -0.381 . . . . 72.24 111.403 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -116.57 132.7 56.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.842 0.354 . . . . 50.55 111.31 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -79.71 -178.61 6.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.126 -0.488 . . . . 72.31 110.409 179.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.72 ' O ' HG23 ' A' ' 60' ' ' VAL . 22.8 mmmt -60.96 -58.46 8.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.788 0.328 . . . . 73.34 110.494 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.29 -30.18 71.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.211 -0.45 . . . . 75.14 110.512 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.35 -39.64 80.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.5 . . . . 71.45 110.443 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.595 HD21 HG12 ' A' ' 26' ' ' ILE . 30.5 mt -79.36 -27.36 41.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.588 -0.733 . . . . 53.35 111.022 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.72 HG23 ' O ' ' A' ' 56' ' ' LYS . 10.9 t -79.9 -44.26 22.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.969 0.414 . . . . 63.51 110.774 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 79.2 m -60.61 -35.8 77.02 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.896 -0.593 . . . . 63.15 110.236 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.428 ' HA ' ' CE1' ' A' ' 41' ' ' HIS . . . -78.7 -23.19 45.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.855 -0.611 . . . . 50.13 110.774 179.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.792 ' HA ' HD21 ' A' ' 29' ' ' LEU . 83.2 t80 -82.97 -22.74 33.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.086 -0.506 . . . . 75.41 111.016 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.434 ' ND2' HG12 ' A' ' 60' ' ' VAL . 39.0 m-80 -85.47 -53.73 5.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 75.44 111.242 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.495 ' HD2' HG21 ' A' ' 69' ' ' THR . 0.1 OUTLIER -63.33 -24.35 67.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.008 -0.542 . . . . 63.45 111.408 -179.427 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.759 HD12 ' CZ ' ' A' ' 37' ' ' PHE . 6.3 tt -56.06 -39.1 71.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.92 0.39 . . . . 75.41 110.904 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.402 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.4 m-85 -77.85 -40.69 39.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.975 -0.557 . . . . 64.11 110.613 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -66.37 -37.73 85.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.542 . . . . 65.24 110.711 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.495 HG21 ' HD2' ' A' ' 65' ' ' HIS . 75.5 p -91.13 -7.25 52.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.964 -0.562 . . . . 74.13 111.329 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.8 mtmt 51.21 35.43 13.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.739 0.304 . . . . 61.41 111.438 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 41.9 mtt-85 -91.93 44.4 1.17 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.374 -0.375 . . . . 73.42 111.146 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.403 ' CE2' ' HD2' ' A' ' 6' ' ' PRO . 88.9 m-85 -65.72 176.53 1.51 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.288 -0.414 . . . . 74.41 110.701 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.5 tttt . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 74.24 110.897 179.976 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.794 0.33 . . . . 64.11 110.955 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -154.82 167.33 30.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.285 -0.416 . . . . 73.42 111.015 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 82.0 m -136.72 103.52 5.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.016 -0.538 . . . . 75.51 110.725 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 190' ' ' LEU . 21.5 ptmt -108.14 151.45 25.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.948 0.404 . . . . 73.35 111.196 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.434 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.4 OUTLIER -142.49 123.16 14.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.952 -0.567 . . . . 74.32 110.547 179.829 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.609 ' O ' HG13 ' A' ' 115' ' ' VAL . 9.1 p -77.56 106.24 7.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.284 -0.417 . . . . 72.11 111.173 -179.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.5 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.5 mm? -77.73 -42.18 35.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 71.13 110.855 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.3 tttm -130.46 108.18 9.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 65.14 110.962 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 138.28 57.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 72.0 110.844 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.503 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -109.22 -156.19 17.01 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.631 -0.795 . . . . 75.22 112.645 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -36.53 -51.21 0.83 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.919 0.39 . . . . 73.4 111.651 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 66.99 34.58 5.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.836 -0.62 . . . . 75.55 110.296 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 55.1 m -151.88 -44.06 0.11 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.697 -0.683 . . . . 72.14 110.66 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -91.5 92.65 8.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 73.53 110.903 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -100.74 153.66 37.61 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 73.03 110.791 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.601 ' HB2' HG21 ' A' ' 166' ' ' VAL . 59.5 Cg_endo -71.88 125.55 11.12 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.52 2.147 . . . . 70.31 112.443 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.0 mtmm -95.54 156.9 16.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.113 -0.494 . . . . 73.24 110.956 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.8 mttp -57.88 118.71 5.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 74.33 110.865 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 99.24 -23.44 36.29 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.643 -0.789 . . . . 74.33 112.507 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.414 ' O ' HG22 ' A' ' 166' ' ' VAL . 3.5 m-20 -78.6 136.91 37.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.746 0.308 . . . . 73.11 110.738 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.599 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 17.1 m -73.12 173.46 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.107 0.479 . . . . 63.42 111.655 -179.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.683 HG12 HG23 ' A' ' 223' ' ' ILE . 19.4 m -156.78 145.87 11.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.507 -0.769 . . . . 73.31 110.568 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.444 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.3 OUTLIER -126.16 117.72 23.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.639 0.257 . . . . 74.13 110.454 179.506 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' CYS . . . . . 0.436 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.9 p -150.8 169.91 20.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.104 0.478 . . . . 54.31 111.512 -179.225 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' TRP . . . . . 0.511 ' O ' HG13 ' A' ' 218' ' ' VAL . 85.6 m95 -101.88 156.35 17.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.559 -0.746 . . . . 73.14 109.531 179.246 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.569 ' H ' HD11 ' A' ' 149' ' ' ILE . 31.8 p90 -161.27 137.66 8.34 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 120.314 -0.554 . . . . 74.21 112.304 -179.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.954 HG21 HG11 ' A' ' 5' ' ' VAL . 12.8 m -127.88 111.56 13.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.485 -0.779 . . . . 62.04 110.195 179.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . 0.555 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.52 145.54 17.88 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.577 -0.821 . . . . 74.01 113.13 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.738 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.6 OUTLIER -150.71 153.02 34.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.8 0.334 . . . . 62.14 110.893 179.834 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.618 HD12 ' HB ' ' A' ' 143' ' ' THR . 69.5 mt -92.07 179.23 5.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.01 110.757 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -57.04 -44.4 82.9 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.961 0.41 . . . . 73.35 110.996 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.01 -8.54 56.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.968 -0.56 . . . . 70.53 111.313 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 95.94 25.81 12.47 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.644 -0.789 . . . . 54.44 112.523 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . 0.618 ' HB ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -93.89 112.59 24.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.836 0.35 . . . . 72.31 110.777 179.977 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.434 HG12 HG23 ' A' ' 138' ' ' THR . 4.6 m -63.7 135.08 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 73.03 111.142 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.463 ' HB2' HD11 ' A' ' 208' ' ' ILE . 39.9 p90 -116.27 -39.39 3.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.49 . . . . 72.14 110.882 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -143.41 110.3 5.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.042 -0.526 . . . . 72.52 110.751 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.453 ' CG2' HG23 ' A' ' 136' ' ' THR . 67.3 m -142.82 107.57 4.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 73.42 111.138 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -97.74 35.42 1.69 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 73.25 110.477 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.569 HD11 ' H ' ' A' ' 135' ' ' TYR . 20.2 mm . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.08 -0.509 . . . . 72.44 111.095 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.801 0.334 . . . . 74.11 111.056 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 6.5 mttm -146.38 149.53 37.97 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 63.31 110.959 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.07 155.73 68.16 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.603 2.202 . . . . 73.04 112.223 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.66 123.64 24.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 72.01 110.692 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 163' ' ' SER . . . . . 0.655 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.5 OUTLIER -104.81 124.5 49.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.895 0.378 . . . . 64.25 111.083 179.866 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 164' ' ' PHE . . . . . 0.713 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 16.3 p90 -151.26 142.14 22.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 75.13 110.906 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . 0.599 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 33.0 mttt -74.24 133.75 42.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.431 . . . . 73.35 111.174 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . 0.601 HG21 ' HB2' ' A' ' 125' ' ' PRO . 35.0 m -87.76 149.35 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.863 -0.608 . . . . 74.54 111.085 -179.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 69.28 22.07 76.08 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.777 -0.725 . . . . 74.0 112.608 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 168' ' ' VAL . . . . . 0.588 HG21 ' CB ' ' A' ' 165' ' ' LYS . 11.8 m -132.38 44.16 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.904 0.383 . . . . 60.33 111.059 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.17 36.36 4.02 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.171 -0.537 . . . . 51.2 113.223 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.59 -47.1 14.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.96 0.409 . . . . 53.31 110.881 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 171' ' ' VAL . . . . . 0.42 HG22 ' CE1' ' A' ' 164' ' ' PHE . 0.0 OUTLIER -119.37 -178.66 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.98 -0.554 . . . . 73.11 110.895 179.778 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 172' ' ' ILE . . . . . 0.564 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 4.2 pt -58.16 159.58 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.333 -0.394 . . . . 72.34 111.143 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -68.56 -29.61 68.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.347 -0.388 . . . . 75.44 111.152 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -72.57 -38.39 57.55 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.542 -0.837 . . . . 73.34 111.888 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 175' ' ' TRP . . . . . 0.608 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.0 t90 -77.65 -32.54 53.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.865 0.365 . . . . 75.45 110.94 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -62.61 -34.46 77.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.08 -0.509 . . . . 53.32 110.305 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -78.41 -29.86 47.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.993 -0.549 . . . . 71.31 110.679 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 178' ' ' ALA . . . . . 0.538 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -78.78 -59.07 2.93 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.163 -0.472 . . . . 73.31 111.293 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.713 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 4.6 mt -57.83 -30.78 66.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.986 -0.552 . . . . 75.42 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 180' ' ' LEU . . . . . 0.413 ' HA ' ' HG2' ' A' ' 125' ' ' PRO . 34.4 tp -59.47 -31.01 68.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.39 -0.368 . . . . 73.13 110.84 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.86 1.78 56.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 63.11 111.358 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.48 150.43 36.66 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.834 0.349 . . . . 71.35 110.927 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.57 165.63 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.248 -0.433 . . . . 71.34 111.22 -179.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . 0.751 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.7 OUTLIER -61.03 117.93 6.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.998 -0.546 . . . . 64.42 110.764 179.859 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 185' ' ' GLY . . . . . 0.405 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 69.35 65.95 2.42 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.678 -0.772 . . . . 70.54 112.272 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 186' ' ' GLU . . . . . 0.503 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 28.0 tt0 -144.48 145.09 31.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.62 0.248 . . . . 75.01 110.403 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt -118.63 137.02 53.57 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.21 -0.293 . . . . 71.42 110.21 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.21 173.79 11.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.18 0.514 . . . . 71.41 111.966 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.73 125.32 22.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.479 -0.782 . . . . 72.04 109.607 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 190' ' ' LEU . . . . . 0.538 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.7 pt? -137.2 143.13 42.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.274 0.559 . . . . 52.1 112.352 -179.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 191' ' ' GLU . . . . . 0.857 ' HG2' HG23 ' A' ' 215' ' ' THR . 6.6 mt-10 -117.13 111.01 18.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.289 -0.868 . . . . 74.45 109.862 179.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 192' ' ' ILE . . . . . 0.449 HD12 HD11 ' A' ' 172' ' ' ILE . 23.5 mt -104.76 141.52 20.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.024 0.44 . . . . 72.21 111.657 -179.116 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -74.02 163.23 69.82 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.758 -0.656 . . . . 74.12 110.947 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 194' ' ' PRO . . . . . 0.437 ' HG3' ' N ' ' A' ' 212' ' ' ALA . 48.7 Cg_exo -56.33 -36.31 96.92 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.756 2.304 . . . . 72.13 112.382 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -57.26 -42.32 81.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.26 -0.427 . . . . 72.52 111.13 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 196' ' ' TRP . . . . . 0.445 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 20.2 m0 -97.58 36.92 1.43 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 74.15 110.933 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 197' ' ' ALA . . . . . 0.438 ' HA ' HG21 ' A' ' 172' ' ' ILE . . . -160.24 -79.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.989 -0.55 . . . . 73.41 110.587 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 198' ' ' TYR . . . . . 0.582 ' CD2' HD11 ' A' ' 214' ' ' LEU . 42.6 m-85 -105.86 -71.24 0.75 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 60.14 110.352 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.19 178.13 16.16 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.831 -0.7 . . . . 74.14 112.818 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.27 -33.51 67.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.879 0.371 . . . . 72.32 110.86 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.13 -57.02 14.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.107 -0.497 . . . . 72.42 110.633 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.17 170.19 25.02 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.862 -0.685 . . . . 75.13 112.548 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 203' ' ' GLN . . . . . 0.603 ' CB ' HD12 ' A' ' 208' ' ' ILE . 2.5 mm-40 -106.48 85.69 1.86 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.726 0.298 . . . . 74.23 110.698 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -63.4 -21.74 71.35 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.572 2.182 . . . . 52.12 112.554 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.59 -42.28 74.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.877 0.37 . . . . 75.24 110.876 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -97.67 28.21 3.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.096 -0.502 . . . . 71.11 111.306 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 56.01 36.51 27.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.394 -0.366 . . . . 73.3 111.013 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 208' ' ' ILE . . . . . 0.603 HD12 ' CB ' ' A' ' 203' ' ' GLN . 40.9 mt -103.94 114.24 64.69 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.151 -0.477 . . . . 70.44 111.045 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.66 171.72 10.41 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.442 2.095 . . . . 74.25 112.364 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.96 128.62 14.25 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.607 2.205 . . . . 72.41 112.426 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 211' ' ' ASN . . . . . 0.418 ' HA ' ' HG2' ' A' ' 194' ' ' PRO . 16.9 m-80 64.26 69.79 0.51 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.127 -0.488 . . . . 71.13 111.0 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 212' ' ' ALA . . . . . 0.437 ' N ' ' HG3' ' A' ' 194' ' ' PRO . . . -127.85 124.91 38.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 65.54 111.493 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 213' ' ' LYS . . . . . 0.501 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.7 OUTLIER -65.19 153.94 39.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 74.55 110.365 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 214' ' ' LEU . . . . . 0.582 HD11 ' CD2' ' A' ' 198' ' ' TYR . 8.5 mt -131.14 109.49 10.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.947 0.403 . . . . 71.24 111.842 -179.264 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 215' ' ' THR . . . . . 0.857 HG23 ' HG2' ' A' ' 191' ' ' GLU . 25.4 m -100.99 135.98 41.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 61.14 110.32 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 216' ' ' PHE . . . . . 0.555 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 21.1 p90 -153.96 173.46 15.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.112 0.482 . . . . 74.11 111.653 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -132.61 136.37 46.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.637 -0.71 . . . . 72.13 110.426 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 218' ' ' VAL . . . . . 0.608 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.1 t -123.83 151.49 28.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.07 0.462 . . . . 72.43 111.968 -178.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -136.83 110.71 8.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.696 -0.683 . . . . 72.24 110.292 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 220' ' ' LEU . . . . . 0.751 HD22 ' HA ' ' A' ' 184' ' ' LYS . 1.7 tt -70.05 131.08 43.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 72.02 111.102 -179.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 221' ' ' VAL . . . . . 0.41 HG23 ' HA ' ' A' ' 133' ' ' CYS . 20.1 t -110.34 -29.21 2.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.112 -0.494 . . . . 75.53 111.452 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 222' ' ' ASP . . . . . 0.413 ' N ' HD23 ' A' ' 220' ' ' LEU . 4.1 t70 -170.81 161.31 7.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.917 0.389 . . . . 74.42 111.069 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 223' ' ' ILE . . . . . 0.716 HG13 HD21 ' A' ' 220' ' ' LEU . 42.3 mt -141.02 111.01 3.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.078 -0.51 . . . . 73.33 111.116 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 224' ' ' ASP . . . . . 0.417 ' C ' HG22 ' A' ' 130' ' ' VAL . 1.5 t70 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 74.2 110.907 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 mtm . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.81 0.338 . . . . 74.21 111.184 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.56 ' HB1' HH22 ' A' ' 189' ' ' ARG . . . -175.05 96.58 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 62.15 111.092 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -175.29 76.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 70.35 111.089 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.465 ' HB2' ' HB ' ' A' ' 215' ' ' THR . . . -82.57 175.91 9.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 71.3 111.096 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.984 HG11 HG21 ' A' ' 136' ' ' THR . 38.5 t -60.19 111.1 3.47 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 64.25 111.042 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.46 ' HB2' ' CE1' ' A' ' 32' ' ' HIS . 76.7 Cg_endo -77.75 137.35 15.98 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.564 2.176 . . . . 70.32 112.36 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.749 ' CD ' HD11 ' A' ' 149' ' ' ILE . 1.4 tp60 -82.41 153.66 25.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 75.31 110.87 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.8 119.91 5.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.219 -0.446 . . . . 63.54 111.072 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.498 ' HB2' ' NZ ' ' A' ' 187' ' ' LYS . . . -90.97 -34.22 15.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 42.45 110.988 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.567 ' NE1' HD11 ' A' ' 20' ' ' LEU . 1.4 m-90 -113.95 173.17 6.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.141 -0.482 . . . . 74.04 110.943 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.459 ' O ' HD12 ' A' ' 15' ' ' LEU . 4.1 m -118.4 154.5 32.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.018 -0.537 . . . . 74.51 110.719 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.408 HG13 ' CD ' ' A' ' 16' ' ' ARG . 93.1 t -57.47 -35.52 50.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.939 0.4 . . . . 73.23 110.65 179.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -70.19 -28.51 65.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 72.34 111.068 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -82.18 -56.79 3.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.871 0.367 . . . . 74.31 111.098 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.692 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.6 mt -49.6 -64.59 0.76 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.2 -0.454 . . . . 72.41 111.23 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.876 ' HD2' HG11 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -54.04 -25.48 21.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.49 . . . . 73.13 111.182 -179.897 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.7 173.95 0.08 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.957 0.408 . . . . 73.2 111.313 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -110.37 16.93 21.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.865 -0.607 . . . . 71.11 111.182 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -109.8 -20.83 12.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.544 -0.298 . . . . 54.34 111.218 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.763 HD22 HD11 ' A' ' 25' ' ' ILE . 10.4 tt -91.85 129.78 40.94 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.521 -0.309 . . . . 74.23 110.943 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.89 126.33 11.83 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.396 2.064 . . . . 72.45 112.309 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -24.11 67.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 72.23 111.178 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.553 ' HA ' HD12 ' A' ' 26' ' ' ILE . 26.0 mmtt -52.84 -39.25 62.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.359 -0.382 . . . . 73.54 111.374 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.39 -57.6 4.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.272 -0.422 . . . . 64.12 111.04 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.763 HD11 HD22 ' A' ' 20' ' ' LEU . 36.2 mt -44.8 -30.67 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.61 . . . . 65.11 111.479 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.662 ' HB ' HG23 ' A' ' 47' ' ' ILE . 7.1 mt -77.86 -37.33 23.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 74.12 111.008 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -75.37 -24.87 57.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.096 -0.502 . . . . 75.02 111.069 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.489 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 11.8 t80 -72.04 -44.98 62.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.971 0.415 . . . . 63.54 110.837 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.753 HD13 HD13 ' A' ' 43' ' ' LEU . 6.3 mt -68.93 -27.49 65.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 72.32 110.981 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -75.39 -26.57 58.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.271 -0.422 . . . . 70.15 111.127 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.401 ' OE2' ' CD2' ' A' ' 32' ' ' HIS . 0.6 OUTLIER -100.94 -7.2 23.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.413 -0.358 . . . . 71.34 111.317 179.953 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.489 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 10.4 m170 -118.88 -8.73 10.24 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.63 -0.259 . . . . 63.04 111.371 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -123.64 164.74 16.66 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.782 -0.723 . . . . 41.42 112.375 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.7 p -93.21 156.94 16.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.635 0.255 . . . . 71.24 110.535 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.679 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.8 p-10 -48.18 -55.4 10.5 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.745 0.307 . . . . 74.14 111.086 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.7 m -50.47 -48.14 56.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.023 0.439 . . . . 74.34 110.786 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.91 ' CZ ' HD12 ' A' ' 66' ' ' LEU . 1.6 t80 -55.83 -48.66 75.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.842 -0.617 . . . . 75.21 110.44 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.429 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 13.2 mt -66.47 -42.85 86.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.007 -0.542 . . . . 72.21 110.798 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.798 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.39 -41.87 20.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.098 0.475 . . . . 65.31 110.969 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -49.37 -51.44 34.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.623 -0.717 . . . . 74.24 111.062 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -99.95 13.22 34.65 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.98 -0.555 . . . . 70.44 111.287 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.6 mtpt 55.91 41.81 29.54 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.86 0.362 . . . . 74.31 110.862 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.753 HD13 HD13 ' A' ' 29' ' ' LEU . 23.3 mt -92.51 -20.45 20.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.073 -0.512 . . . . 50.31 111.491 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.798 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -80.19 157.72 26.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.122 0.487 . . . . 74.34 111.171 -179.741 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.72 -119.9 4.65 Favored Glycine 0 N--CA 1.451 -0.357 0 CA-C-N 115.608 -0.724 . . . . 61.13 112.417 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.883 ' O ' HG23 ' A' ' 50' ' ' VAL . 17.4 m-80 -116.36 115.14 25.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.72 0.295 . . . . 70.25 110.947 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.662 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.75 -57.22 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.248 -0.433 . . . . 72.11 111.365 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.3 mttt -46.71 -37.23 8.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.87 -0.604 . . . . 65.53 110.944 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -85.7 -26.24 26.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.97 -0.559 . . . . 74.2 111.019 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.6 t -81.21 -26.0 10.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.411 . . . . 51.11 111.371 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.63 -15.69 63.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.436 -0.347 . . . . 51.45 111.164 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.9 ttpp -95.12 -31.32 13.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.307 -0.406 . . . . 75.33 110.919 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.11 -33.63 17.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 65.43 111.142 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.68 127.25 38.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.264 -0.425 . . . . 52.23 111.163 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -83.49 175.89 9.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 73.55 110.663 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.586 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -58.21 -58.12 9.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.88 0.372 . . . . 75.35 110.595 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.43 -27.81 69.55 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.035 -0.529 . . . . 72.31 110.594 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.1 -43.88 98.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.105 -0.498 . . . . 62.43 110.511 179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.648 HD21 HG12 ' A' ' 26' ' ' ILE . 21.1 mt -71.59 -34.45 69.9 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.693 -0.685 . . . . 64.02 111.06 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.876 HG11 ' HD2' ' A' ' 16' ' ' ARG . 11.1 t -76.4 -41.9 35.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.017 0.437 . . . . 63.34 110.922 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.7 m -60.54 -34.26 73.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.892 -0.595 . . . . 73.2 110.654 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.428 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -81.02 -22.12 39.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 74.31 111.138 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.682 ' HA ' HD21 ' A' ' 29' ' ' LEU . 32.4 t80 -83.59 -22.84 32.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.295 -0.412 . . . . 62.31 111.079 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 41.9 m-20 -84.46 -54.24 4.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 71.42 111.49 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 3.1 p-80 -62.08 -32.9 73.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.073 -0.512 . . . . 63.23 111.288 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.91 HD12 ' CZ ' ' A' ' 37' ' ' PHE . 8.3 tt -47.69 -40.52 20.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.887 0.375 . . . . 74.43 111.201 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -78.14 -38.06 44.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.061 -0.518 . . . . 70.02 110.598 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.77 -38.45 86.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.992 -0.549 . . . . 61.15 110.823 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.1 p -87.85 -7.08 57.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 75.51 111.526 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.46 ' HZ2' ' HE1' ' A' ' 72' ' ' PHE . 0.8 OUTLIER 47.65 41.13 13.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.707 0.289 . . . . 70.5 111.556 179.61 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -107.34 46.04 0.96 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.91 0.386 . . . . 72.05 110.845 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.647 ' CD2' HD21 ' A' ' 66' ' ' LEU . 88.3 m-85 -60.58 179.07 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.014 -0.539 . . . . 74.4 110.741 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 41.2 tttm -65.54 135.98 55.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 61.13 110.798 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -113.28 179.99 19.16 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.746 -0.74 . . . . 63.13 112.497 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.758 HG23 ' CG2' ' A' ' 78' ' ' ILE . 69.4 m -61.58 139.15 58.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.834 0.349 . . . . 74.54 110.871 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -145.18 -46.91 0.23 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 74.43 110.943 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.419 ' O ' ' CG1' ' A' ' 78' ' ' ILE . 3.6 m -128.89 -45.2 1.29 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.025 -0.534 . . . . 53.51 110.963 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.758 ' CG2' HG23 ' A' ' 75' ' ' THR . 38.1 pt 45.1 -171.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.893 -0.594 . . . . 74.32 111.699 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 50.1 m -82.44 131.33 35.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.352 -0.386 . . . . 63.42 110.87 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.9 mtpm? -155.75 115.9 3.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 52.14 110.939 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 31.6 m -107.07 -32.3 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 62.52 111.1 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.7 p -173.86 176.51 2.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.438 . . . . 73.14 110.905 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -144.24 118.26 9.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.459 . . . . 51.15 110.871 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -128.28 146.94 50.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 72.43 110.943 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -134.73 104.49 5.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.259 -0.428 . . . . 73.44 111.095 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.02 144.67 56.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 72.4 110.847 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -92.87 111.42 23.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 72.42 110.915 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.5 t 63.85 90.99 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 65.21 111.133 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -173.66 -41.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.434 . . . . 71.01 110.915 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.6 tp 56.84 100.4 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.015 -0.539 . . . . 64.54 111.023 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -156.59 121.68 4.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.235 -0.438 . . . . 75.41 110.935 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 62.65 145.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 73.3 111.029 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -112.77 -34.74 5.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.185 -0.461 . . . . 74.42 110.926 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 16.4 mttm -101.67 158.9 30.9 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 63.14 110.894 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -52.71 -40.52 73.59 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.583 2.189 . . . . 60.03 112.279 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 56.81 -168.22 0.11 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.023 -0.535 . . . . 65.42 111.005 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 61.03 169.07 0.1 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 71.24 110.919 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.566 HG22 ' O ' ' A' ' 98' ' ' THR . 28.7 m -163.63 34.05 0.09 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.2 -0.455 . . . . 74.14 110.868 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 64.51 -79.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 75.04 110.9 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 26.5 m -60.13 146.41 43.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.132 -0.485 . . . . 71.32 110.864 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -144.08 78.63 1.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 70.22 110.892 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -176.65 92.7 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 64.02 110.873 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 8.8 p -106.24 -33.13 7.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 61.43 110.885 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.494 HD23 ' H ' ' A' ' 107' ' ' GLY . 0.5 OUTLIER -166.24 173.96 9.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 74.22 110.915 179.953 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -110.05 -31.02 7.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 64.44 110.971 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -89.64 -31.9 17.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 73.01 110.927 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.494 ' H ' HD23 ' A' ' 104' ' ' LEU . . . 111.07 109.55 3.14 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.736 -0.745 . . . . 52.41 112.394 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.61 162.03 40.98 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.46 2.106 . . . . 45.32 112.306 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.451 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 39.8 Cg_exo -57.15 -160.64 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.647 2.232 . . . . 72.01 112.353 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 19.8 mttt -97.2 37.7 1.31 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.213 -0.449 . . . . 74.31 111.0 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.451 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 21.0 p90 -165.68 166.86 17.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 75.35 110.906 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.456 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 0.3 OUTLIER -134.03 127.66 32.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.479 . . . . 71.42 110.546 179.807 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.01 144.51 49.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.951 0.405 . . . . 74.21 111.231 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.443 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.3 m -143.16 115.34 8.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.004 -0.544 . . . . 63.42 110.71 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 24.2 t -74.61 106.27 4.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.292 -0.413 . . . . 74.33 111.331 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.443 HD12 ' O ' ' A' ' 114' ' ' SER . 6.0 mp -74.04 -63.06 1.3 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 72.45 110.758 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.6 108.07 16.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 70.23 110.878 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.78 140.79 54.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.222 -0.445 . . . . 75.35 110.98 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.509 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -112.37 -154.38 12.17 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.795 -0.717 . . . . 74.33 112.404 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -36.8 -51.9 0.9 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.956 0.408 . . . . 73.3 111.446 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.7 tttm 69.69 35.64 2.34 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.908 -0.587 . . . . 73.12 110.197 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.27 -44.76 0.09 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.702 -0.681 . . . . 73.22 110.724 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -89.08 89.44 7.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 63.42 110.843 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -97.61 154.72 37.83 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.479 . . . . 75.04 110.909 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.79 ' HB2' HG21 ' A' ' 166' ' ' VAL . 56.4 Cg_endo -70.41 125.59 11.97 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.577 2.185 . . . . 52.13 112.356 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -99.75 153.22 19.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 74.11 110.914 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.55 116.9 5.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.245 -0.434 . . . . 75.31 110.856 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 107.42 -23.21 27.21 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.715 -0.755 . . . . 71.42 112.517 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.38 139.73 30.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.771 0.319 . . . . 74.25 110.732 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.612 HG12 ' HG3' ' A' ' 165' ' ' LYS . 16.9 m -70.84 174.32 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.035 0.445 . . . . 75.52 111.432 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.874 HG22 ' O ' ' A' ' 164' ' ' PHE . 20.7 m -157.51 145.49 10.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.66 -0.7 . . . . 64.04 110.387 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.465 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.22 117.72 22.88 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.722 0.296 . . . . 75.42 110.683 179.815 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.491 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 27.3 p -155.2 170.86 20.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.027 0.441 . . . . 62.22 111.191 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.811 ' HB3' HD13 ' A' ' 149' ' ' ILE . 8.8 m95 -106.37 163.64 12.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.84 -0.618 . . . . 75.11 110.21 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.465 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 35.8 p90 -160.97 135.18 7.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.129 0.49 . . . . 71.41 111.751 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.984 HG21 HG11 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -124.41 110.7 14.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.612 -0.722 . . . . 74.53 110.137 179.421 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.611 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.61 144.27 17.07 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.565 -0.826 . . . . 71.32 113.468 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.844 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -151.72 130.26 12.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.681 0.277 . . . . 52.14 110.385 179.596 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.633 HD12 ' HB ' ' A' ' 143' ' ' THR . 35.3 mt -60.93 -178.32 0.1 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.445 -0.343 . . . . 73.32 110.841 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -56.04 -41.48 75.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 74.23 110.746 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -83.56 -0.57 50.94 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.979 -0.555 . . . . 75.03 111.474 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 93.79 25.79 16.75 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.64 -0.791 . . . . 62.31 112.637 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . 0.633 ' HB ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -81.12 111.48 17.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.76 0.314 . . . . 72.21 110.874 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.425 HG21 ' HE3' ' A' ' 70' ' ' LYS . 34.9 t -65.59 120.91 13.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 61.2 111.17 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.443 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 35.2 p90 -112.13 -24.71 9.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 75.45 111.06 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . 0.414 ' HB2' ' CE1' ' A' ' 145' ' ' PHE . 28.9 m-20 -161.89 113.37 1.69 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.427 -0.351 . . . . 74.51 110.94 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.962 HG23 HG23 ' A' ' 136' ' ' THR . 90.0 m -125.29 105.58 9.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 73.42 111.04 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.465 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 19.7 t30 -88.73 -0.62 57.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 73.31 111.27 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.811 HD13 ' HB3' ' A' ' 134' ' ' TRP . 21.7 mm -70.7 85.3 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.757 0.313 . . . . 72.14 110.913 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -74.99 167.93 20.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.283 -0.417 . . . . 64.21 110.893 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . 0.606 ' O ' ' HB2' ' A' ' 159' ' ' ALA . 17.3 p -59.38 166.02 2.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 70.13 110.959 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 12.0 p -75.13 150.19 38.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 75.43 110.901 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.06 -27.28 35.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.469 . . . . 72.14 111.249 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.97 -31.12 64.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.275 -0.421 . . . . 62.33 110.983 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.17 -29.48 17.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 72.51 110.963 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -173.13 125.48 0.43 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 71.14 110.897 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 13.7 mmtt -59.86 94.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 62.34 110.887 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -165.65 42.72 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 61.42 110.885 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.606 ' HB2' ' O ' ' A' ' 151' ' ' THR . . . -141.65 121.94 13.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 54.34 111.094 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -146.38 112.53 4.37 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 52.55 110.844 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.426 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 67.1 Cg_exo -51.01 154.02 7.97 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.422 2.081 . . . . 72.42 112.328 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.428 HD23 ' HD1' ' A' ' 164' ' ' PHE . 3.2 tt -78.35 122.37 25.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 65.01 110.522 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.67 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -100.42 121.35 41.4 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.94 0.4 . . . . 74.54 111.236 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.874 ' O ' HG22 ' A' ' 131' ' ' VAL . 10.1 p90 -150.1 141.74 23.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.98 -0.555 . . . . 74.31 110.731 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.612 ' HG3' HG12 ' A' ' 130' ' ' VAL . 72.6 mttt -77.33 136.63 38.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.083 0.468 . . . . 75.23 111.201 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.79 HG21 ' HB2' ' A' ' 125' ' ' PRO . 32.0 m -87.64 149.38 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.704 -0.68 . . . . 73.54 111.185 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.83 24.09 75.65 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.912 -0.661 . . . . 73.21 112.673 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.785 HG23 ' HG2' ' A' ' 170' ' ' LYS . 14.4 m -132.27 44.77 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.914 0.388 . . . . 61.13 111.043 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.7 36.39 4.67 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 121.188 -0.529 . . . . 72.52 113.215 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . 0.785 ' HG2' HG23 ' A' ' 168' ' ' VAL . 3.0 mmtm -82.99 -47.11 12.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.941 0.401 . . . . 61.21 110.983 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -118.3 -179.65 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.963 -0.562 . . . . 75.2 110.992 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.542 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -58.82 159.54 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 75.33 111.23 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -68.25 -26.1 65.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 71.44 111.297 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -77.84 -37.06 30.75 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.669 -0.777 . . . . 51.13 112.198 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.599 ' CD1' HD11 ' A' ' 190' ' ' LEU . 2.4 t90 -77.3 -33.57 55.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.897 0.38 . . . . 73.33 111.17 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.96 -37.16 83.76 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.016 -0.538 . . . . 74.14 110.617 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -73.27 -30.07 63.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.016 -0.538 . . . . 64.51 110.731 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.736 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -83.4 -48.82 9.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.147 -0.479 . . . . 62.31 111.249 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.57 HD21 HG21 ' A' ' 218' ' ' VAL . 9.4 mt -63.47 -34.42 77.72 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.074 -0.512 . . . . 61.45 110.801 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 35.6 tp -55.71 -23.12 27.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 74.42 111.115 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 51.1 p -98.64 2.25 47.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.368 -0.378 . . . . 61.21 111.567 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.413 ' HE1' ' O ' ' A' ' 186' ' ' GLU . 0.0 OUTLIER -77.19 152.39 34.82 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.729 0.299 . . . . 65.44 110.737 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -115.43 161.99 17.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.31 -0.405 . . . . 45.31 111.259 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -60.05 122.51 14.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.94 -0.573 . . . . 74.31 110.461 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 66.72 60.41 6.19 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.556 -0.83 . . . . 54.52 112.373 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . 0.509 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 17.1 tt0 -141.58 148.28 39.03 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.306 -0.257 . . . . 74.34 110.306 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . 0.498 ' NZ ' ' HB2' ' A' ' 9' ' ' ALA . 9.9 ttpt -117.26 135.61 53.69 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.184 -0.302 . . . . 74.31 110.184 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.73 168.9 18.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.126 0.489 . . . . 75.44 111.809 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . 0.56 HH22 ' HB1' ' A' ' 2' ' ' ALA . 0.1 OUTLIER -137.72 101.11 4.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.597 -0.729 . . . . 75.44 109.711 179.139 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.749 HD12 HD11 ' A' ' 192' ' ' ILE . 0.3 OUTLIER -115.34 143.91 44.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.101 0.477 . . . . 74.01 112.06 -178.853 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.687 ' HB3' HG23 ' A' ' 215' ' ' THR . 8.3 pt-20 -118.0 115.07 24.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.603 -0.726 . . . . 74.25 110.531 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.749 HD11 HD12 ' A' ' 190' ' ' LEU . 3.3 mp -96.93 134.79 33.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 74.04 111.247 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -70.89 166.1 40.66 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.912 -0.586 . . . . 73.33 110.808 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.94 -14.42 44.44 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.579 2.186 . . . . 64.32 112.604 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -79.64 -25.71 41.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.68 0.276 . . . . 70.34 111.245 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . . . . . . . . . 12.8 m0 -117.1 37.08 3.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.452 -0.34 . . . . 72.01 111.277 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -145.97 -83.46 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.353 -0.385 . . . . 70.24 111.356 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . 0.639 ' CE2' HD13 ' A' ' 208' ' ' ILE . 15.8 m-85 -109.43 -34.5 6.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.901 0.381 . . . . 62.33 110.875 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 118.18 170.02 14.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.85 -0.69 . . . . 72.1 112.577 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.89 -29.0 62.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.806 0.336 . . . . 64.12 110.926 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -66.67 -50.69 62.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.224 -0.444 . . . . 73.25 110.856 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 115.31 -162.66 12.4 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.87 -0.681 . . . . 54.11 112.468 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.547 ' HB3' HD12 ' A' ' 208' ' ' ILE . 1.2 tm0? -137.0 77.65 42.78 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.891 0.377 . . . . 52.43 110.863 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.61 -23.23 24.91 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.625 2.216 . . . . 55.42 112.422 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.96 -41.89 79.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.298 -0.41 . . . . 74.01 111.046 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.96 30.4 6.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.088 -0.506 . . . . 73.11 111.126 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.32 35.67 25.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 73.02 110.918 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.639 HD13 ' CE2' ' A' ' 198' ' ' TYR . 32.0 mt -98.53 111.74 60.78 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.454 . . . . 75.34 111.095 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.13 171.11 15.48 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.478 2.119 . . . . 54.41 112.373 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.56 142.12 69.93 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.586 2.19 . . . . 73.21 112.265 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 54.18 69.44 0.72 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.208 -0.451 . . . . 64.22 111.024 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . 0.516 ' HB1' HD22 ' A' ' 139' ' ' LEU . . . -122.43 115.02 21.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.258 -0.428 . . . . 63.32 111.466 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -65.35 131.49 46.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.043 -0.526 . . . . 75.53 110.452 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.512 HD11 ' CE2' ' A' ' 198' ' ' TYR . 4.9 mt -113.58 109.41 18.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.896 0.379 . . . . 64.34 111.68 -179.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.687 HG23 ' HB3' ' A' ' 191' ' ' GLU . 2.8 m -109.59 140.1 43.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.546 . . . . 73.13 110.417 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.611 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 4.7 p90 -156.32 -179.29 8.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.013 0.435 . . . . 72.54 111.387 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -134.34 137.65 44.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.721 -0.672 . . . . 74.44 110.432 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.573 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.7 t -120.32 151.76 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.99 0.424 . . . . 63.32 111.997 -179.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -136.33 105.87 6.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.777 -0.647 . . . . 72.1 110.221 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.552 HD21 ' CG1' ' A' ' 223' ' ' ILE . 1.0 OUTLIER -69.96 129.5 39.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.343 -0.39 . . . . 70.33 110.845 -179.755 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 33.7 t -108.24 -28.99 2.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.266 -0.424 . . . . 65.3 111.426 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -171.18 162.23 6.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.839 0.352 . . . . 60.14 111.024 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.644 HG23 HG12 ' A' ' 131' ' ' VAL . 46.5 mt -140.75 111.16 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 61.22 111.135 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . 0.589 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 64.31 110.817 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 mtm . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.79 0.329 . . . . 70.5 111.208 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -132.44 173.21 11.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 73.41 111.095 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -158.96 97.65 1.42 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 74.21 111.057 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 59.33 96.75 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 72.24 111.131 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.892 HG11 HG21 ' A' ' 136' ' ' THR . 49.1 t -60.18 110.67 3.04 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 52.13 110.952 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.426 ' HD2' ' CE1' ' A' ' 72' ' ' PHE . 85.6 Cg_endo -80.46 145.46 16.67 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.632 2.221 . . . . 70.3 112.426 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -81.28 149.72 28.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.267 -0.424 . . . . 74.23 110.884 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.63 98.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 70.42 111.33 -179.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.429 ' HB2' ' HE3' ' A' ' 187' ' ' LYS . . . -68.58 -19.19 64.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.983 -0.553 . . . . 63.44 111.391 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.599 ' CD1' HD11 ' A' ' 20' ' ' LEU . 2.9 m-90 -136.99 173.89 11.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.96 0.409 . . . . 74.13 110.914 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.45 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.1 OUTLIER -115.64 150.89 35.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.871 -0.604 . . . . 70.25 110.475 179.673 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.541 HG12 ' HD2' ' A' ' 16' ' ' ARG . 32.7 t -56.11 -32.01 32.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.929 0.395 . . . . 72.55 110.818 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -73.98 -26.29 60.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.959 -0.564 . . . . 71.41 111.21 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.45 ' HB2' HG23 ' A' ' 11' ' ' THR . 6.2 mm100 -82.26 -57.27 3.45 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.892 0.377 . . . . 73.0 111.095 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.754 ' HB3' HG22 ' A' ' 60' ' ' VAL . 3.5 mt -49.67 -63.46 1.1 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.153 -0.476 . . . . 64.55 111.158 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.541 ' HD2' HG12 ' A' ' 12' ' ' VAL . 19.7 mtt180 -54.34 -24.42 19.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.125 -0.489 . . . . 65.24 111.217 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.08 176.97 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.944 0.402 . . . . 75.02 111.115 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -110.35 16.69 21.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.941 -0.572 . . . . 73.01 111.13 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -108.34 -28.02 9.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.519 -0.31 . . . . 74.54 111.093 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.599 HD11 ' CD1' ' A' ' 10' ' ' TRP . 7.0 tt -85.9 113.11 49.8 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.334 -0.393 . . . . 71.24 110.967 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -56.39 123.96 15.11 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.401 2.067 . . . . 72.13 112.172 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -24.11 65.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 74.44 111.089 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.7 mmtp -53.7 -33.59 55.96 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.281 -0.418 . . . . 65.12 111.332 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -78.76 -51.87 9.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.966 0.413 . . . . 71.41 110.998 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.552 HD11 HD22 ' A' ' 20' ' ' LEU . 31.1 mt -46.82 -33.17 2.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.896 -0.593 . . . . 74.44 111.311 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.668 HG12 HD21 ' A' ' 59' ' ' LEU . 12.1 mt -74.95 -52.94 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.084 0.468 . . . . 74.53 111.015 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.684 ' HG3' HD11 ' A' ' 47' ' ' ILE . 0.1 OUTLIER -57.01 -22.8 41.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.752 -0.658 . . . . 75.04 111.323 -179.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -75.08 -49.37 19.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.966 0.413 . . . . 55.12 110.851 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.891 HD23 HD12 ' A' ' 66' ' ' LEU . 4.3 mt -65.5 -26.63 68.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.914 -0.585 . . . . 75.22 110.938 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -81.27 -27.03 35.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.295 -0.411 . . . . 70.15 111.038 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.426 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -97.09 -6.13 35.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.492 -0.322 . . . . 75.25 111.198 179.714 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.426 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 92.2 m-70 -128.4 -3.23 5.52 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.346 . . . . 70.42 111.484 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.65 157.21 15.58 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.711 -0.757 . . . . 74.41 112.289 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.4 p -92.66 149.89 21.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.624 0.25 . . . . 65.44 110.625 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.938 ' HA ' HD12 ' A' ' 38' ' ' LEU . 0.6 OUTLIER -44.15 -49.77 8.9 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.405 -0.361 . . . . 74.12 111.49 -179.796 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.6 p -55.03 -47.42 74.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.008 0.433 . . . . 55.12 110.506 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.492 ' CE2' ' CE1' ' A' ' 65' ' ' HIS . 4.1 t80 -58.13 -44.12 87.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.692 . . . . 72.41 110.703 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.938 HD12 ' HA ' ' A' ' 35' ' ' ASP . 3.1 mt -63.57 -49.19 74.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.256 -0.429 . . . . 71.04 110.895 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.829 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -49.2 -28.19 4.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.115 -0.493 . . . . 64.14 111.349 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -77.43 -33.1 54.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 60.12 111.218 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.684 ' ND1' ' HB2' ' A' ' 62' ' ' ALA . 6.3 m-70 -108.78 10.42 26.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.395 -0.366 . . . . 74.24 111.58 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' A' ' 38' ' ' LEU . 12.8 mttp 60.21 31.86 20.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.779 0.323 . . . . 65.23 110.992 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.618 HD11 ' HB1' ' A' ' 62' ' ' ALA . 64.5 mt -84.56 -21.12 30.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 73.31 111.054 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.829 HD11 ' HB2' ' A' ' 39' ' ' ALA . 61.7 mt -48.75 170.34 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.944 0.402 . . . . 64.03 111.104 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.27 -163.39 34.26 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.784 -0.722 . . . . 62.41 112.78 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.884 ' O ' HG23 ' A' ' 50' ' ' VAL . 1.7 t-20 -102.85 148.77 25.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.88 0.372 . . . . 74.12 111.016 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.684 HD11 ' HG3' ' A' ' 27' ' ' LYS . 3.1 mp -45.27 -43.29 3.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.015 -0.539 . . . . 70.1 111.498 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -56.44 -42.33 77.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.877 -0.601 . . . . 73.33 111.092 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -85.74 -28.17 24.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.084 -0.507 . . . . 74.53 111.336 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 46' ' ' ASN . 14.2 t -77.41 -26.42 15.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 75.21 111.478 -179.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.55 -25.24 65.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.383 -0.371 . . . . 53.54 111.311 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.3 pttt -95.22 -30.95 13.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.311 -0.404 . . . . 52.31 111.136 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 m -84.98 -22.21 29.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 73.23 111.381 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -113.0 128.7 56.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.828 0.347 . . . . 62.12 111.283 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -78.9 179.89 7.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 74.04 110.447 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.623 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -60.82 -58.48 8.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.84 0.353 . . . . 70.12 110.537 179.96 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.49 -26.38 67.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.109 -0.496 . . . . 63.05 110.6 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.67 -40.4 94.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.114 0.483 . . . . 64.24 110.261 179.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.668 HD21 HG12 ' A' ' 26' ' ' ILE . 17.4 mt -77.42 -30.04 53.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.659 -0.701 . . . . 65.33 111.036 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.754 HG22 ' HB3' ' A' ' 15' ' ' LEU . 17.8 t -79.11 -43.33 24.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.942 0.401 . . . . 65.12 110.752 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 75.4 m -60.05 -34.49 73.49 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.895 -0.593 . . . . 73.44 110.486 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.684 ' HB2' ' ND1' ' A' ' 41' ' ' HIS . . . -82.01 -21.72 36.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.006 -0.543 . . . . 52.42 110.898 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.769 ' HA ' HD21 ' A' ' 29' ' ' LEU . 16.3 t80 -83.79 -22.78 31.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 72.31 110.97 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -85.07 -54.33 4.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.136 -0.483 . . . . 62.21 111.479 -179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.492 ' CE1' ' CE2' ' A' ' 37' ' ' PHE . 2.9 p-80 -62.08 -25.34 67.64 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.16 -0.473 . . . . 74.34 111.385 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.891 HD12 HD23 ' A' ' 29' ' ' LEU . 3.4 tt -53.65 -39.89 65.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.967 0.413 . . . . 74.04 110.945 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.401 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.2 m-85 -79.06 -39.88 32.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.93 -0.577 . . . . 64.42 110.641 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.1 -40.31 90.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.985 -0.552 . . . . 71.1 110.957 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 57.9 p -88.06 -9.77 52.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.033 -0.53 . . . . 74.45 111.413 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.21 33.63 12.87 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.763 0.316 . . . . 72.14 111.192 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 66.6 mtt-85 -92.52 46.18 1.23 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.356 -0.384 . . . . 65.34 111.019 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.562 ' CE1' HD22 ' A' ' 66' ' ' LEU . 91.9 m-85 -67.17 175.8 2.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 65.43 110.856 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 49.4 tttt -73.07 152.98 41.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.352 -0.385 . . . . 74.12 110.882 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -157.4 127.57 1.95 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.738 -0.744 . . . . 72.25 112.569 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.2 p 57.92 107.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.829 0.347 . . . . 62.24 110.95 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -176.01 -39.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 64.13 110.94 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.551 ' O ' HG23 ' A' ' 78' ' ' ILE . 19.6 p -139.39 117.53 11.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.09 -0.505 . . . . 75.44 110.9 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.551 HG23 ' O ' ' A' ' 77' ' ' SER . 9.2 pt -159.02 -42.55 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.175 -0.466 . . . . 62.12 111.24 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 70.4 m 60.57 111.06 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.153 -0.476 . . . . 62.35 110.881 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 29.7 mttt -134.48 126.01 28.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 54.22 110.891 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.562 HG22 ' O ' ' A' ' 81' ' ' VAL . 10.3 p -92.24 52.36 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 74.34 111.046 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 65.7 m -152.97 149.31 28.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.11 -0.495 . . . . 72.13 110.902 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -100.97 -42.58 6.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 61.32 110.847 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 59.32 99.04 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.002 -0.545 . . . . 72.04 110.953 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t 59.28 88.41 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.47 . . . . 74.42 111.174 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.5 mmtt -151.02 -176.63 5.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.449 . . . . 60.24 110.962 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -89.67 141.13 28.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 53.44 110.854 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 12.5 p -68.64 137.65 23.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 74.11 111.102 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.4 tttp -175.74 -40.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 73.4 110.946 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -128.03 136.67 51.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.092 -0.504 . . . . 71.3 110.93 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -128.25 132.66 48.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 62.21 110.876 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -83.83 158.03 21.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 73.45 110.935 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.34 -34.1 7.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 52.53 110.91 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -173.18 150.66 1.94 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 70.02 110.898 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.52 -172.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.54 2.16 . . . . 72.12 112.287 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -177.29 -39.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 75.11 110.936 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -103.1 133.96 47.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 74.32 110.935 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.8 t -130.1 141.48 50.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.237 -0.438 . . . . 74.04 110.926 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -108.03 -179.18 3.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 64.42 110.891 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 57.4 m 62.76 -80.56 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.152 -0.476 . . . . 60.42 111.015 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 60.29 35.7 20.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.239 -0.437 . . . . 75.1 110.961 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -102.87 111.48 23.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.173 -0.467 . . . . 62.05 110.88 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 73.3 p -78.96 145.15 34.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 73.43 110.908 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.1 mp -138.98 -178.12 5.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 52.0 110.925 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -81.6 -177.62 6.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 73.41 110.894 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -89.85 97.73 11.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.449 . . . . 74.01 110.919 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 91.48 52.48 2.32 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.728 -0.749 . . . . 62.45 112.552 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.16 171.46 14.85 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.601 2.201 . . . . 65.15 112.307 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.34 -176.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.574 2.183 . . . . 65.14 112.252 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.442 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.1 OUTLIER -103.07 28.69 6.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 60.11 110.959 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 30.8 p90 -149.46 162.23 40.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 75.02 110.819 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 5.8 m -132.0 103.55 6.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 75.43 111.058 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.408 ' CB ' ' HB3' ' A' ' 190' ' ' LEU . 0.8 OUTLIER -111.09 145.16 39.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.207 -0.451 . . . . 65.31 110.797 179.915 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.425 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.5 m -137.97 130.77 29.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 75.11 110.941 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 22.1 t -80.47 106.32 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 50.12 111.14 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.433 HD13 ' HA ' ' A' ' 188' ' ' ALA . 7.4 mp -76.28 -50.01 15.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.224 -0.444 . . . . 75.02 110.768 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.85 111.55 16.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.089 -0.505 . . . . 74.21 110.902 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.95 142.35 46.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 75.11 110.904 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.488 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -114.57 -155.78 11.27 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.741 -0.742 . . . . 23.4 112.615 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -37.21 -52.43 1.05 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.013 0.435 . . . . 72.5 111.415 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 71.22 35.84 1.49 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.789 -0.642 . . . . 73.2 110.178 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 57.2 m -152.98 -43.81 0.1 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.712 -0.676 . . . . 73.23 110.692 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -92.73 95.85 9.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 72.2 110.838 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -107.41 146.12 32.64 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.138 -0.483 . . . . 61.2 110.756 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -56.35 125.34 18.75 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.429 2.086 . . . . 73.32 112.454 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.02 150.37 22.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.981 -0.554 . . . . 63.32 110.909 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -53.93 114.18 1.49 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.42 . . . . 72.34 110.856 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.14 -23.62 33.87 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.58 -0.819 . . . . 53.43 112.356 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.673 ' O ' HG22 ' A' ' 166' ' ' VAL . 0.6 OUTLIER -81.58 135.59 35.56 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.817 0.341 . . . . 73.4 110.628 179.877 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.575 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 12.8 m -73.62 175.78 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.284 0.564 . . . . 44.33 111.795 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.719 HG12 HG23 ' A' ' 223' ' ' ILE . 20.5 m -157.29 146.37 10.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.247 -0.888 . . . . 71.24 110.509 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.451 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -125.43 117.29 23.35 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.983 -0.287 . . . . 72.31 110.624 179.623 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.483 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 30.9 p -153.97 167.07 30.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.951 0.405 . . . . 75.52 111.151 -179.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.629 ' HB3' HD11 ' A' ' 149' ' ' ILE . 62.2 m95 -99.67 160.73 14.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.922 -0.581 . . . . 75.44 110.074 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 34.3 p90 -158.63 134.97 9.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.102 0.477 . . . . 73.41 111.747 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.906 HG23 HG23 ' A' ' 147' ' ' THR . 0.2 OUTLIER -126.89 111.67 14.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.72 -0.673 . . . . 63.54 110.188 179.392 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.591 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.66 144.04 17.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.562 -0.828 . . . . 62.14 113.27 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.71 HG23 HG13 ' A' ' 144' ' ' VAL . 0.2 OUTLIER -150.62 142.11 23.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.806 0.336 . . . . 63.35 110.554 179.642 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.68 HD12 ' HB ' ' A' ' 143' ' ' THR . 87.7 mt -77.96 -178.21 5.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.262 -0.426 . . . . 74.5 110.93 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -58.86 -43.33 90.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.296 -0.411 . . . . 72.23 110.895 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -75.82 -4.72 42.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.96 -0.564 . . . . 55.25 111.448 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . 0.533 ' C ' HG22 ' A' ' 138' ' ' THR . . . 92.61 23.07 27.05 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.679 -0.772 . . . . 74.11 112.655 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . 0.68 ' HB ' HD12 ' A' ' 139' ' ' LEU . 1.3 m -88.28 108.31 19.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.811 0.339 . . . . 62.03 110.776 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.71 HG13 HG23 ' A' ' 138' ' ' THR . 3.7 m -71.16 132.64 33.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 60.43 111.275 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -112.19 -31.19 6.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 63.51 110.895 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -143.83 123.03 12.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 73.34 110.98 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.906 HG23 HG23 ' A' ' 136' ' ' THR . 82.9 m -137.45 105.69 5.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 61.13 110.72 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.525 ' C ' HD12 ' A' ' 149' ' ' ILE . 52.6 t30 -86.17 12.6 9.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 74.55 111.702 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.684 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.6 mp -115.78 118.91 60.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 120.83 0.348 . . . . 71.24 110.903 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -123.8 -67.68 0.92 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 74.03 110.902 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 70.1 p -126.9 166.01 18.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 53.15 110.937 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.7 m -84.03 167.82 16.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.462 . . . . 64.21 110.915 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -80.98 -30.74 35.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 73.24 111.164 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 3.8 mtmt -59.72 -33.22 71.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.439 . . . . 75.23 110.926 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.3 -34.94 71.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 75.14 110.833 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.64 -179.18 0.79 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 60.54 110.808 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 4.0 tptt -99.05 31.41 3.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.475 . . . . 73.43 110.898 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -104.72 31.39 4.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 72.22 110.95 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -152.79 119.25 5.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 63.4 111.081 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -146.56 148.22 33.12 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 72.14 110.779 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.84 156.68 65.0 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.474 2.116 . . . . 44.02 112.233 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.2 128.02 32.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.083 -0.508 . . . . 61.04 110.746 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.61 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.6 OUTLIER -105.41 126.68 52.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.27 -0.423 . . . . 62.03 111.054 179.817 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.694 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 19.3 p90 -151.0 140.94 21.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 75.31 110.977 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.616 ' CB ' HG21 ' A' ' 168' ' ' VAL . 10.3 mtpt -69.65 131.25 44.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.333 -0.394 . . . . 64.21 110.828 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.673 HG22 ' O ' ' A' ' 129' ' ' ASP . 34.4 m -87.88 149.21 4.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 55.33 111.182 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 67.99 25.09 74.46 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.764 -0.732 . . . . 61.43 112.595 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.616 HG21 ' CB ' ' A' ' 165' ' ' LYS . 15.7 m -134.24 46.17 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.9 0.381 . . . . 75.05 111.121 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.59 35.52 3.0 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.212 -0.518 . . . . 72.43 113.276 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . 0.43 ' CG ' HG23 ' A' ' 168' ' ' VAL . 0.0 OUTLIER -82.15 -47.08 12.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.887 0.375 . . . . 72.12 111.056 -179.91 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . 0.443 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.8 OUTLIER -118.48 -179.58 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.049 -0.523 . . . . 61.03 110.971 179.829 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.539 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.22 158.39 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.453 -0.34 . . . . 72.31 111.197 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 23.5 ttm180 -66.52 -28.57 68.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.295 -0.411 . . . . 72.1 111.301 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.48 -36.53 43.72 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.659 -0.781 . . . . 63.21 112.16 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.745 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.3 t90 -78.99 -34.37 44.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.916 0.388 . . . . 64.33 111.096 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -62.46 -38.01 88.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 64.14 110.423 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . 0.551 ' O ' HG23 ' A' ' 181' ' ' THR . 2.9 mm-40 -75.45 -29.82 59.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.986 -0.552 . . . . 53.54 110.644 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.634 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -78.76 -58.32 3.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.153 -0.476 . . . . 70.35 111.128 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.694 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 5.8 mt -56.73 -34.38 67.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.983 -0.553 . . . . 51.34 110.898 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 16.4 tp -59.91 -30.34 68.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.248 -0.433 . . . . 64.25 110.694 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . 0.551 HG23 ' O ' ' A' ' 177' ' ' GLU . 32.5 p -87.11 -3.58 59.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 63.33 111.291 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 71.4 mmm -78.17 154.3 31.27 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.794 0.33 . . . . 70.23 110.718 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 10.4 p -121.19 170.33 9.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 54.42 111.175 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . 0.676 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -61.94 117.43 5.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.011 -0.541 . . . . 72.24 110.776 179.876 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . 0.407 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 70.48 66.82 2.08 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.701 -0.762 . . . . 31.44 112.224 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . 0.488 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 19.0 tt0 -146.02 147.25 31.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.636 0.255 . . . . 74.44 110.563 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . 0.429 ' HE3' ' HB2' ' A' ' 9' ' ' ALA . 2.8 ttpm? -121.98 136.54 54.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.761 0.315 . . . . 72.12 110.262 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . 0.433 ' HA ' HD13 ' A' ' 116' ' ' LEU . . . -150.0 176.16 11.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.076 0.465 . . . . 74.43 111.495 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.76 135.17 36.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.795 -0.639 . . . . 64.33 109.594 178.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.634 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.2 pt? -140.12 140.02 35.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.2 0.524 . . . . 73.4 112.361 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.682 ' HB3' HG23 ' A' ' 215' ' ' THR . 0.0 OUTLIER -116.3 112.05 20.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.54 -0.754 . . . . 61.44 109.912 178.954 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.53 HD11 ' CZ ' ' A' ' 216' ' ' PHE . 2.1 mp -97.47 143.08 13.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.001 0.429 . . . . 70.2 111.543 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -76.89 154.88 83.11 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.861 -0.609 . . . . 62.34 110.676 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . 0.452 ' CG ' ' HA ' ' A' ' 211' ' ' ASN . 73.4 Cg_exo -50.89 -39.84 58.36 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.629 2.219 . . . . 74.31 112.419 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.31 -40.63 82.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 73.42 111.235 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.442 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 5.7 m0 -96.64 36.84 1.33 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.396 -0.365 . . . . 73.51 111.147 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -162.83 -76.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 75.52 110.888 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . 0.656 ' CD2' HD11 ' A' ' 214' ' ' LEU . 25.7 m-85 -106.27 -71.21 0.76 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 73.32 110.672 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 143.05 -179.9 20.25 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.799 -0.715 . . . . 55.4 112.673 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -59.34 -33.06 70.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.846 0.355 . . . . 53.32 110.903 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -51.73 48.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 64.51 110.783 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 113.51 -138.82 15.23 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.868 -0.682 . . . . 73.43 112.474 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.649 ' CB ' HD12 ' A' ' 208' ' ' ILE . 0.4 OUTLIER -153.99 79.62 5.12 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.862 0.363 . . . . 62.41 110.824 179.99 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.9 -22.93 25.66 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.577 2.185 . . . . 63.55 112.41 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.8 -41.96 87.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.399 -0.364 . . . . 72.51 110.965 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.429 ' HB3' HG13 ' A' ' 208' ' ' ILE . . . -111.35 27.89 9.25 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.173 -0.467 . . . . 64.12 111.19 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 55.48 30.83 15.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.233 -0.44 . . . . 75.24 111.077 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.649 HD12 ' CB ' ' A' ' 203' ' ' GLN . 31.1 mt -82.14 112.66 37.57 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.431 . . . . 74.33 111.074 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -60.04 158.99 27.44 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.474 2.116 . . . . 73.01 112.303 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -55.71 145.44 71.2 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.618 2.212 . . . . 71.51 112.284 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . 0.452 ' HA ' ' CG ' ' A' ' 194' ' ' PRO . 3.2 m-80 45.0 40.93 4.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.15 -0.477 . . . . 62.11 111.358 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -83.24 112.27 19.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 73.13 111.796 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.2 mmmm -65.02 140.63 58.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.009 -0.542 . . . . 75.3 110.276 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.656 HD11 ' CD2' ' A' ' 198' ' ' TYR . 5.4 mt -117.89 109.78 16.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.949 0.405 . . . . 74.22 112.026 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.682 HG23 ' HB3' ' A' ' 191' ' ' GLU . 1.9 m -109.16 142.88 39.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.917 -0.583 . . . . 63.11 110.061 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.598 ' CE1' HD21 ' A' ' 190' ' ' LEU . 14.8 p90 -156.57 -179.27 8.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.118 0.485 . . . . 73.54 111.617 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -131.34 135.16 47.02 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.612 -0.722 . . . . 74.13 110.418 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.745 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.8 t -122.82 150.46 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.457 . . . . 71.52 111.915 -179.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.67 110.45 8.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.733 -0.667 . . . . 75.35 110.256 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.726 HD21 HG13 ' A' ' 223' ' ' ILE . 2.0 tt -69.84 128.55 36.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.39 -0.368 . . . . 54.01 111.02 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 24.6 t -108.51 -29.07 2.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.158 -0.474 . . . . 62.45 111.296 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . 0.407 ' N ' HD23 ' A' ' 220' ' ' LEU . 5.4 t70 -170.41 161.14 7.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.881 0.372 . . . . 72.13 111.006 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.726 HG13 HD21 ' A' ' 220' ' ' LEU . 41.7 mt -140.19 110.62 3.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.096 -0.502 . . . . 71.12 111.057 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . 0.524 ' HB2' HG23 ' A' ' 130' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 74.03 110.859 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mtt . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.797 0.332 . . . . 74.32 111.186 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.655 ' HB3' ' HA3' ' A' ' 142' ' ' GLY . . . -140.62 169.7 17.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 53.43 111.078 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -157.56 107.25 2.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 43.01 111.092 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 59.26 163.63 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 53.44 111.084 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 1.041 HG11 HG21 ' A' ' 136' ' ' THR . 50.3 t -123.9 123.27 26.21 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.233 -0.439 . . . . 63.45 111.157 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -81.59 138.84 10.97 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.738 2.292 . . . . 71.54 112.325 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.436 HE22 HD11 ' A' ' 149' ' ' ILE . 11.5 mm100 -81.14 148.84 29.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 70.42 111.052 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.565 ' NE ' HD13 ' A' ' 149' ' ' ILE . 0.0 OUTLIER -51.92 120.59 5.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 74.25 111.102 -179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -94.95 -10.96 29.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.065 -0.516 . . . . 72.34 111.403 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.612 ' CD1' HD11 ' A' ' 20' ' ' LEU . 3.8 m-90 -138.19 173.67 11.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.912 0.386 . . . . 74.1 110.863 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.433 ' O ' HD12 ' A' ' 15' ' ' LEU . 1.3 m -118.22 152.06 36.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.009 -0.541 . . . . 75.02 110.661 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.506 HG12 ' HD2' ' A' ' 16' ' ' ARG . 34.2 t -57.71 -33.34 44.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.369 -0.378 . . . . 74.41 110.685 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -77.37 -24.94 50.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.964 -0.562 . . . . 62.5 111.037 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.03 -57.65 3.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.832 0.348 . . . . 70.25 110.843 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.709 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.4 mt -51.1 -60.71 2.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.221 -0.445 . . . . 72.24 111.001 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.619 ' HG3' HG11 ' A' ' 60' ' ' VAL . 28.1 mtt180 -54.16 -24.14 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 75.24 111.114 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.12 177.86 0.31 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.307 -0.406 . . . . 70.15 111.045 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -110.31 16.72 21.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.935 -0.575 . . . . 72.21 111.167 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -104.39 -27.86 11.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.514 -0.312 . . . . 73.24 111.156 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.834 HD22 HD11 ' A' ' 25' ' ' ILE . 6.5 tt -86.84 132.16 42.97 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.394 -0.366 . . . . 75.31 111.015 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.636 ' N ' HD23 ' A' ' 20' ' ' LEU . 71.1 Cg_endo -74.48 124.97 9.28 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.52 2.147 . . . . 74.44 112.398 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.402 ' HB3' ' NZ ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -56.93 -26.33 59.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 74.42 111.188 -179.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 mmtp -54.65 -49.06 71.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.301 -0.409 . . . . 62.52 111.293 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.05 -33.17 74.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.127 -0.488 . . . . 72.13 111.19 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.834 HD11 HD22 ' A' ' 20' ' ' LEU . 30.1 mt -66.9 -36.53 77.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 62.23 111.223 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.692 HG12 HD21 ' A' ' 59' ' ' LEU . 15.8 mt -71.85 -50.16 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.229 -0.442 . . . . 62.02 111.105 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.509 ' HG3' HD11 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -57.35 -22.9 45.53 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.847 -0.615 . . . . 45.21 111.286 -179.856 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -74.46 -50.81 16.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.013 0.435 . . . . 71.44 110.809 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.75 HD21 ' HA ' ' A' ' 63' ' ' TYR . 4.5 mt -64.3 -39.17 93.37 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.87 -0.605 . . . . 73.24 110.957 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -71.18 -20.22 62.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.309 -0.405 . . . . 73.22 110.727 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.444 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 9.4 tp10 -79.58 -52.21 8.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.133 -0.485 . . . . 64.54 111.472 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.444 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 84.4 m-70 -111.18 16.48 21.0 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 111.876 0.325 . . . . 73.23 111.876 -179.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' A' ' 29' ' ' LEU . . . -123.05 91.08 0.44 Allowed Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.517 -0.849 . . . . 71.05 112.631 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.1 p -33.68 156.08 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.672 0.619 . . . . 55.21 112.672 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.467 ' HA ' HD12 ' A' ' 38' ' ' LEU . 1.8 p-10 -51.45 -55.91 16.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.673 -0.694 . . . . 63.35 111.443 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.2 t -47.83 -48.05 31.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.04 0.447 . . . . 53.34 110.702 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.493 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 15.9 t80 -55.05 -49.0 72.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.678 -0.692 . . . . 75.5 110.727 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.748 HD22 ' HB3' ' A' ' 43' ' ' LEU . 11.6 mt -62.54 -45.54 92.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 64.14 110.937 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.947 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -49.93 -31.89 13.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.295 -0.411 . . . . 62.31 111.309 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -71.35 -33.15 69.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 74.11 111.034 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.534 ' ND1' ' HB2' ' A' ' 62' ' ' ALA . 14.3 m-70 -110.03 13.32 23.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.348 -0.387 . . . . 75.02 111.502 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt 58.86 33.67 23.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.794 0.331 . . . . 65.1 111.004 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.748 ' HB3' HD22 ' A' ' 38' ' ' LEU . 17.8 mt -88.76 -20.1 25.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.28 -0.418 . . . . 73.03 111.107 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.947 HD11 ' HB2' ' A' ' 39' ' ' ALA . 84.1 mt -47.77 170.32 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.894 0.378 . . . . 51.15 111.175 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.45 -154.78 24.45 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.771 -0.728 . . . . 64.41 112.778 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.87 ' O ' HG23 ' A' ' 50' ' ' VAL . 40.5 m-20 -109.92 150.4 28.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.96 0.41 . . . . 72.44 111.078 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.509 HD11 ' HG3' ' A' ' 27' ' ' LYS . 3.2 mp -46.71 -39.6 4.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.972 -0.558 . . . . 75.24 111.434 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -60.21 -42.45 95.18 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.057 -0.52 . . . . 64.43 111.102 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -85.56 -26.62 26.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.077 -0.51 . . . . 52.43 111.216 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.87 HG23 ' O ' ' A' ' 46' ' ' ASN . 17.5 t -79.58 -25.83 12.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.405 . . . . 73.53 111.448 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.42 -27.74 68.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.388 -0.369 . . . . 52.5 111.127 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.9 ptpp? -95.18 -29.21 14.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 65.15 110.986 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -96.34 33.55 1.76 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.449 . . . . 63.12 111.13 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -163.68 125.79 2.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.366 -0.379 . . . . 75.42 111.123 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.22 174.64 11.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 73.44 110.633 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.593 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -57.68 -58.29 8.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.892 0.377 . . . . 73.14 110.521 179.945 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.56 -24.48 67.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.005 -0.543 . . . . 72.33 110.584 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.21 -42.57 99.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.15 -0.477 . . . . 64.22 110.375 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.692 HD21 HG12 ' A' ' 26' ' ' ILE . 15.3 mt -74.85 -29.99 61.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.714 -0.675 . . . . 75.32 111.059 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.709 HG22 ' HB3' ' A' ' 15' ' ' LEU . 12.4 t -80.4 -43.87 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.987 0.422 . . . . 73.11 110.824 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.7 m -58.86 -34.33 71.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.93 -0.577 . . . . 73.41 110.532 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.534 ' HB2' ' ND1' ' A' ' 41' ' ' HIS . . . -83.59 -21.77 32.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.997 -0.547 . . . . 62.21 110.952 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.75 ' HA ' HD21 ' A' ' 29' ' ' LEU . 26.8 t80 -82.29 -22.88 35.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 70.42 111.025 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.568 ' ND2' HG12 ' A' ' 60' ' ' VAL . 48.3 m-80 -85.82 -53.18 5.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 74.2 111.474 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.493 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.2 p-80 -62.76 -27.5 69.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.991 -0.549 . . . . 73.31 111.498 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.711 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.5 tt -50.67 -40.68 54.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.871 0.367 . . . . 62.45 111.091 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -79.05 -40.84 30.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.015 -0.539 . . . . 72.4 110.682 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.82 -38.58 91.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.978 -0.556 . . . . 73.41 111.012 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.9 p -87.35 -11.84 48.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.091 -0.504 . . . . 61.55 111.46 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.724 ' HD3' HG21 ' A' ' 144' ' ' VAL . 25.0 mtmt 55.07 32.26 17.9 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.737 0.303 . . . . 75.13 111.161 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 30.9 mtt-85 -91.53 47.22 1.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.32 -0.4 . . . . 71.05 111.023 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -68.28 171.84 6.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 71.53 110.855 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.5 tttp -73.23 153.06 40.8 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.28 -0.418 . . . . 74.42 110.928 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -90.65 -149.09 22.18 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.755 -0.736 . . . . 71.43 112.469 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 12.8 p -100.03 92.44 5.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.792 0.33 . . . . 73.22 110.885 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -110.29 -32.98 6.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.241 -0.436 . . . . 73.32 110.907 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.3 m -173.29 125.35 0.41 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 62.53 110.887 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 4.7 mt -127.86 140.1 50.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 64.01 111.048 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.4 m 62.01 116.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 53.34 110.947 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 34.9 mmtm -149.8 147.9 28.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 73.45 110.861 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 11.3 p -144.11 131.52 17.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 74.01 111.074 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.1 t -149.79 -57.42 0.19 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 73.25 110.909 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -101.33 147.0 26.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 71.41 110.916 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.662 ' O ' HG13 ' A' ' 85' ' ' VAL . 4.4 mm100 -68.55 162.99 24.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.222 -0.445 . . . . 73.3 110.977 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.662 HG13 ' O ' ' A' ' 84' ' ' GLN . 0.8 OUTLIER -163.84 145.59 2.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.916 -0.584 . . . . 75.1 111.117 -179.664 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -159.36 -56.9 0.06 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.444 . . . . 74.42 110.883 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.0 t30 60.94 97.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 74.31 110.917 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.485 HG22 ' N ' ' A' ' 89' ' ' LYS . 11.2 p -80.36 158.58 4.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 73.51 111.031 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.485 ' N ' HG22 ' A' ' 88' ' ' VAL . 8.0 tptt -174.33 -40.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 75.42 110.929 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.2 mt -151.23 30.75 0.61 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.101 -0.499 . . . . 74.35 110.935 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 14.1 m120 59.95 109.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.215 -0.448 . . . . 55.33 110.932 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.06 147.13 48.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 73.35 110.847 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -128.5 147.5 50.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 73.03 110.908 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -158.56 87.33 2.32 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 75.42 110.899 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.09 124.1 14.03 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.6 2.2 . . . . 63.44 112.317 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 20.8 mttt 60.8 168.3 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.182 -0.463 . . . . 72.04 110.884 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.57 -172.03 0.22 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 54.13 110.926 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.6 t -102.23 155.57 18.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 75.3 110.918 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 2.0 tttp 60.35 31.64 20.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 74.3 110.916 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 16.7 m -136.59 120.32 17.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 74.41 110.896 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -100.95 99.2 9.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 65.53 110.899 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -138.08 31.17 2.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 71.23 110.899 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 5.0 t -131.38 -46.06 0.99 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 64.03 110.925 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 59.63 109.26 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.031 -0.532 . . . . 60.42 110.928 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -104.25 -53.26 2.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 54.44 110.935 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -179.87 -38.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.929 -0.578 . . . . 73.02 110.929 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 158.81 92.21 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.775 -0.726 . . . . 70.31 112.453 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.14 165.73 29.25 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.594 2.196 . . . . 65.42 112.334 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.405 ' HB3' ' CH2' ' A' ' 196' ' ' TRP . 63.3 Cg_exo -51.52 179.09 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.633 2.222 . . . . 54.41 112.307 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.461 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.4 OUTLIER -108.43 23.97 13.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 75.0 111.123 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.448 ' CZ ' ' HB2' ' A' ' 177' ' ' GLU . 4.1 p90 -132.73 -176.56 4.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 73.52 110.622 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.48 105.59 1.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.796 0.332 . . . . 75.33 111.06 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.483 ' CG ' HD22 ' A' ' 190' ' ' LEU . 0.0 OUTLIER -101.66 139.92 36.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 75.22 110.808 179.837 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.436 ' O ' ' HB1' ' A' ' 188' ' ' ALA . 0.4 OUTLIER -132.34 122.72 25.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 63.23 110.905 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.608 ' O ' HG13 ' A' ' 115' ' ' VAL . 9.5 p -84.0 106.38 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.472 . . . . 54.04 111.067 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.575 HD22 ' N ' ' A' ' 116' ' ' LEU . 2.8 mm? -87.68 -43.33 12.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 73.02 110.788 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 11.8 ttpp -118.22 107.9 14.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 73.23 110.94 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.08 134.36 55.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.211 -0.45 . . . . 74.14 111.057 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -103.23 -106.03 3.02 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.716 -0.754 . . . . 71.32 112.329 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.79 -42.78 11.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.96 0.41 . . . . 71.03 110.703 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.09 33.9 3.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.952 -0.567 . . . . 74.13 110.836 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 61.2 m -156.32 -45.6 0.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 71.23 110.839 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 -83.22 91.88 7.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 63.03 110.972 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -103.71 141.79 23.24 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 71.03 110.821 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.69 125.55 19.44 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.493 2.128 . . . . 72.22 112.356 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -97.98 158.88 15.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.117 -0.492 . . . . 64.03 110.849 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.91 111.13 1.18 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.275 -0.42 . . . . 71.4 110.809 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 111.33 -36.66 4.09 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.755 -0.736 . . . . 61.14 112.338 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.606 ' O ' HG22 ' A' ' 166' ' ' VAL . 0.5 OUTLIER -71.1 130.93 42.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 63.12 110.677 179.854 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.536 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 5.9 m -73.86 179.71 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.98 0.419 . . . . 70.2 111.429 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.804 HG12 HG23 ' A' ' 223' ' ' ILE . 21.5 m -156.84 147.69 11.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.8 -0.636 . . . . 74.34 110.916 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.427 ' HB3' ' HB2' ' A' ' 161' ' ' PRO . 0.7 OUTLIER -124.94 117.7 24.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.553 -0.294 . . . . 63.1 110.38 179.496 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.5 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.1 p -153.73 166.88 31.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.999 0.428 . . . . 55.43 111.509 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.624 ' O ' HG13 ' A' ' 218' ' ' VAL . 54.9 m95 -100.44 163.73 12.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.796 -0.638 . . . . 73.21 110.159 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.453 ' CD1' ' HB2' ' A' ' 148' ' ' ASN . 27.9 p90 -159.2 135.19 8.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.888 0.375 . . . . 64.23 111.593 -179.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 1.041 HG21 HG11 ' A' ' 5' ' ' VAL . 3.4 m -122.47 106.39 10.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.088 -0.505 . . . . 63.41 110.941 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.738 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -85.98 135.79 13.67 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.938 -0.649 . . . . 70.12 113.32 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.868 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -147.43 143.19 27.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.802 0.334 . . . . 73.53 110.617 179.599 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 139' ' ' LEU . 32.3 mt -81.95 -177.47 6.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 64.44 110.871 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -56.76 -42.86 80.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.167 -0.469 . . . . 44.11 110.902 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.61 -9.07 58.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.949 -0.569 . . . . 72.3 111.31 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . 0.655 ' HA3' ' HB3' ' A' ' 2' ' ' ALA . . . 93.33 25.86 17.63 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.64 -0.79 . . . . 72.12 112.569 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 30.4 m -87.32 108.59 19.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.808 0.337 . . . . 61.1 110.87 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.724 HG21 ' HD3' ' A' ' 70' ' ' LYS . 21.2 t -63.72 127.46 24.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 51.54 111.089 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.428 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 52.1 p90 -110.13 -31.09 7.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.272 -0.422 . . . . 72.2 110.919 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -167.88 112.19 0.66 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 74.52 110.87 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.65 ' OG1' HG23 ' A' ' 136' ' ' THR . 11.9 t -125.07 126.9 46.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.211 -0.45 . . . . 53.01 110.965 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.453 ' HB2' ' CD1' ' A' ' 135' ' ' TYR . 8.8 t30 -65.58 -21.81 66.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.126 -0.488 . . . . 74.33 111.159 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.565 HD13 ' NE ' ' A' ' 8' ' ' ARG . 21.4 mt -106.15 119.72 55.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.393 -0.367 . . . . 61.23 111.417 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.9 -43.96 0.43 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.221 -0.445 . . . . 62.35 111.105 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 74.6 p -98.75 153.63 18.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.376 -0.374 . . . . 55.42 110.863 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 5.8 t -115.05 166.83 11.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 74.15 110.897 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -72.8 -29.65 63.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 33.41 111.156 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.95 -61.67 2.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.218 -0.447 . . . . 65.45 110.932 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.98 -63.08 1.42 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.924 -0.58 . . . . 65.32 110.917 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.4 tptt -150.66 119.65 6.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.888 -0.596 . . . . 73.44 110.874 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -65.26 80.22 0.05 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 65.42 110.893 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 24.7 m-20 -143.26 83.03 1.77 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 62.21 110.927 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.465 ' HB1' ' CH2' ' A' ' 134' ' ' TRP . . . -157.2 122.73 4.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 52.34 111.052 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 7.4 mtpt -131.13 119.36 17.74 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 72.1 110.881 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.427 ' HB2' ' HB3' ' A' ' 132' ' ' HIS . 54.0 Cg_exo -52.44 151.16 18.83 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.418 2.079 . . . . 74.14 112.26 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 2.5 tt -79.12 127.78 32.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 74.24 110.706 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.607 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 1.1 p -109.02 127.42 54.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.919 0.39 . . . . 63.14 111.346 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.772 ' CZ ' HD12 ' A' ' 179' ' ' LEU . 15.6 p90 -153.13 145.27 23.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.965 -0.562 . . . . 75.45 110.713 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.643 ' O ' HG22 ' A' ' 168' ' ' VAL . 15.8 mtmt -71.8 134.34 46.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.959 0.409 . . . . 74.31 111.028 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.606 HG22 ' O ' ' A' ' 129' ' ' ASP . 27.0 m -87.93 149.17 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.94 -0.573 . . . . 74.34 111.345 -179.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 62.43 29.24 72.78 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.827 -0.701 . . . . 73.51 112.607 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.643 HG22 ' O ' ' A' ' 165' ' ' LYS . 35.4 m -116.76 -33.01 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.927 0.394 . . . . 63.3 111.578 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 111.99 31.29 2.72 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.69 -0.767 . . . . 61.23 111.443 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -88.59 -29.71 19.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.759 0.314 . . . . 70.41 111.067 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 14.8 m -121.75 179.63 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 75.25 111.245 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.502 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 2.7 pt -59.58 169.45 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.108 -0.496 . . . . 63.22 111.082 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -76.05 -28.41 57.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.315 -0.402 . . . . 72.0 111.099 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -73.15 -30.57 62.76 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.72 -0.752 . . . . 74.55 112.015 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.794 ' HE1' HG21 ' A' ' 218' ' ' VAL . 0.6 OUTLIER -84.05 -34.46 24.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.88 0.372 . . . . 74.12 110.838 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -58.31 -40.76 82.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.036 -0.529 . . . . 73.11 110.488 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . 0.448 ' HB2' ' CZ ' ' A' ' 111' ' ' TYR . 4.8 mt-10 -80.14 -29.4 38.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.847 -0.615 . . . . 74.41 110.631 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.483 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -76.07 -60.77 2.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.205 -0.452 . . . . 64.31 111.23 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.772 HD12 ' CZ ' ' A' ' 164' ' ' PHE . 0.3 OUTLIER -56.3 -35.04 67.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.975 -0.557 . . . . 73.32 110.992 -179.95 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.5 tp -64.76 -28.4 69.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 63.43 111.06 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 22.4 m -89.5 -8.81 52.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.3 -0.409 . . . . 63.53 111.444 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -77.6 156.29 30.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.819 0.342 . . . . 75.31 110.963 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.81 168.96 9.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 73.23 110.875 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . 0.605 ' HA ' HD11 ' A' ' 223' ' ' ILE . 16.6 tttp -68.36 125.31 26.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.272 -0.422 . . . . 71.54 110.99 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 70.28 35.34 69.71 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.834 -0.698 . . . . 72.24 112.597 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -120.37 147.24 45.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.831 0.348 . . . . 75.22 110.922 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt -114.82 140.49 48.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 72.1 110.117 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . 0.436 ' HB1' ' O ' ' A' ' 114' ' ' SER . . . -147.58 175.86 10.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.028 0.442 . . . . 75.04 111.705 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . 0.469 ' C ' HD23 ' A' ' 190' ' ' LEU . 0.0 OUTLIER -128.23 120.05 26.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.777 -0.647 . . . . 72.13 109.981 179.568 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.857 ' O ' HG23 ' A' ' 215' ' ' THR . 3.5 mt -99.4 161.66 13.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.429 0.633 . . . . 71.42 112.271 -179.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -149.13 105.11 3.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.843 -1.071 . . . . 63.14 109.696 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.547 HG21 ' O ' ' A' ' 196' ' ' TRP . 3.0 mt -111.7 138.12 41.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.065 0.459 . . . . 75.45 111.798 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.423 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.3 mt-10 -75.84 167.83 33.22 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.647 -0.706 . . . . 54.44 110.445 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . 0.423 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 36.3 Cg_endo -64.8 -15.56 50.91 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.46 2.107 . . . . 74.33 112.633 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.14 -24.78 30.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.567 -0.288 . . . . 72.34 111.701 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.547 ' O ' HG21 ' A' ' 192' ' ' ILE . 3.0 m0 -110.37 37.18 2.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.74 0.305 . . . . 74.41 111.558 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . 0.487 ' HB1' HD12 ' A' ' 214' ' ' LEU . . . -149.78 -83.07 0.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.428 -0.351 . . . . 72.34 111.43 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . 0.647 ' CE2' HD13 ' A' ' 208' ' ' ILE . 25.5 m-85 -107.72 -31.65 7.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.98 0.419 . . . . 73.02 110.921 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 119.61 169.18 14.13 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.875 -0.679 . . . . 61.4 112.629 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.01 -29.75 44.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.885 0.374 . . . . 73.22 110.834 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -67.34 -46.88 72.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.081 -0.509 . . . . 73.52 110.68 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.56 -141.81 16.74 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.819 -0.705 . . . . 74.33 112.396 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.647 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.0 OUTLIER -155.77 79.41 4.25 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 120.846 0.355 . . . . 64.42 110.773 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.16 -22.68 26.53 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.65 2.233 . . . . 74.13 112.567 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.01 -42.05 84.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.898 0.38 . . . . 62.22 110.992 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.73 31.2 6.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.116 -0.493 . . . . 70.03 111.11 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 18.1 mtpt 56.86 32.95 22.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.246 -0.434 . . . . 75.55 110.935 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.647 HD12 ' HB3' ' A' ' 203' ' ' GLN . 50.4 mt -93.26 111.8 53.55 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.143 -0.481 . . . . 74.22 111.046 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -69.16 170.67 15.32 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.426 2.084 . . . . 61.02 112.384 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.23 151.47 49.04 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.63 2.22 . . . . 73.4 112.461 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . 0.401 ' HA ' ' CG ' ' A' ' 194' ' ' PRO . 24.2 m-80 57.15 24.86 10.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 71.11 111.329 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -83.75 147.22 27.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.894 0.378 . . . . 74.43 111.467 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . 0.728 ' O ' HD23 ' A' ' 214' ' ' LEU . 1.0 OUTLIER -93.92 156.09 16.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 72.14 110.303 179.519 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.728 HD23 ' O ' ' A' ' 213' ' ' LYS . 14.1 mt -136.4 109.51 7.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.953 0.406 . . . . 52.13 111.857 -179.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.857 HG23 ' O ' ' A' ' 190' ' ' LEU . 94.9 m -111.27 141.19 45.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.933 -0.576 . . . . 74.53 110.251 179.504 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.738 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 21.4 p90 -161.78 120.12 2.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.951 0.405 . . . . 74.52 111.73 -179.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.68 139.45 47.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.022 -0.535 . . . . 75.32 110.813 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.794 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.6 t -123.02 151.32 27.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.997 -0.547 . . . . 60.31 111.102 -179.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -136.8 111.32 8.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.281 -0.418 . . . . 64.24 110.639 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.735 HD13 HD11 ' A' ' 223' ' ' ILE . 0.4 OUTLIER -69.56 129.54 39.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.842 0.353 . . . . 71.13 110.835 -179.722 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 40.1 t -107.37 -30.54 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.475 . . . . 74.44 111.07 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -167.74 157.8 10.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.211 -0.45 . . . . 62.24 110.895 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.804 HG23 HG12 ' A' ' 131' ' ' VAL . 3.9 mp -141.14 111.31 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 74.11 111.091 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 34.5 t70 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 62.21 110.935 -179.961 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.4 mtt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.784 0.326 . . . . 73.54 111.191 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.22 142.42 28.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 71.22 111.102 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.788 ' HB2' ' O ' ' A' ' 139' ' ' LEU . . . 61.88 152.19 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.447 . . . . 62.01 111.009 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.562 ' HB2' ' O ' ' A' ' 3' ' ' ALA . . . 168.33 76.52 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.153 -0.476 . . . . 75.23 111.144 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.702 HG23 ' OG1' ' A' ' 138' ' ' THR . 42.4 t -83.68 112.48 40.22 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.507 -0.315 . . . . 72.22 110.798 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.454 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.3 Cg_endo -78.48 134.67 12.64 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.654 2.236 . . . . 74.21 112.525 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -80.19 156.54 26.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.178 -0.464 . . . . 61.13 110.807 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.25 93.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 60.24 111.379 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.77 -37.44 86.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 73.33 110.992 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.573 ' CD1' HD11 ' A' ' 20' ' ' LEU . 1.5 m-90 -115.46 173.64 6.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.966 -0.561 . . . . 73.53 110.689 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.482 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -118.2 154.77 31.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.101 -0.5 . . . . 73.51 110.618 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.513 HG21 ' HG2' ' A' ' 154' ' ' LYS . 95.9 t -57.11 -35.87 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.973 0.416 . . . . 64.31 110.501 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -67.96 -30.34 69.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.87 -0.605 . . . . 41.44 111.143 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -82.04 -56.09 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.37 -0.377 . . . . 74.32 111.238 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.755 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.5 mt -49.55 -65.6 0.54 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.285 -0.416 . . . . 75.3 111.327 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.899 ' HD2' HG11 ' A' ' 60' ' ' VAL . 0.1 OUTLIER -53.71 -25.49 18.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 65.21 111.259 -179.898 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.42 173.68 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.99 0.424 . . . . 75.52 111.36 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.38 17.04 21.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.888 -0.596 . . . . 72.41 111.176 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -112.23 -19.98 12.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.655 0.264 . . . . 73.42 111.307 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.573 HD11 ' CD1' ' A' ' 10' ' ' TRP . 2.1 tt -90.59 112.18 51.68 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.609 -0.269 . . . . 74.54 111.008 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -57.69 128.42 29.1 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.411 2.074 . . . . 72.42 112.227 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.834 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -63.4 -24.15 67.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.462 . . . . 74.24 111.204 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.458 ' HA ' HD12 ' A' ' 26' ' ' ILE . 3.6 tptt -51.76 -40.13 59.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.394 -0.366 . . . . 74.5 111.581 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.89 -57.42 4.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.957 0.408 . . . . 70.43 111.164 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.834 HD12 ' HA ' ' A' ' 22' ' ' LYS . 4.7 mt -44.81 -32.78 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.891 -0.595 . . . . 75.44 111.556 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.673 HG12 HD21 ' A' ' 59' ' ' LEU . 7.4 mt -75.1 -40.7 44.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.937 0.399 . . . . 74.11 110.991 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -71.02 -24.03 62.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.977 -0.556 . . . . 63.33 111.029 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 24.1 t80 -71.47 -45.05 63.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.041 0.448 . . . . 53.41 110.86 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.854 HD13 HD13 ' A' ' 43' ' ' LEU . 6.1 mt -69.57 -24.01 63.64 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.783 -0.644 . . . . 74.52 111.11 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -79.3 -25.05 42.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.348 -0.387 . . . . 74.4 111.005 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.1 -10.58 18.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.384 -0.371 . . . . 72.33 111.24 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 11.9 m170 -117.62 -9.7 10.73 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.54 -0.3 . . . . 75.52 111.438 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.49 164.4 15.53 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.688 -0.768 . . . . 64.21 112.379 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.98 150.4 21.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.683 0.277 . . . . 61.51 110.555 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.681 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.5 OUTLIER -48.55 -57.01 6.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.833 0.349 . . . . 45.54 111.02 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.92 -49.57 39.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.054 0.454 . . . . 51.22 110.625 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.55 ' CE2' HD12 ' A' ' 66' ' ' LEU . 14.8 t80 -54.61 -48.02 72.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.707 -0.678 . . . . 63.24 110.431 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.419 HD21 ' O ' ' A' ' 29' ' ' LEU . 14.6 mt -63.98 -42.02 97.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.933 -0.576 . . . . 75.32 110.837 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.824 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -46.68 -40.29 12.96 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.187 -0.46 . . . . 71.12 111.05 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.432 ' HB3' ' CD2' ' A' ' 41' ' ' HIS . 0.6 OUTLIER -48.56 -50.13 33.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.806 -0.634 . . . . 73.24 111.09 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.432 ' CD2' ' HB3' ' A' ' 40' ' ' GLU . 5.3 m-70 -102.46 14.04 32.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.088 -0.505 . . . . 74.25 111.293 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.2 mttt 57.47 42.0 25.21 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.842 0.353 . . . . 74.55 110.959 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.854 HD13 HD13 ' A' ' 29' ' ' LEU . 19.8 mt -92.25 -22.43 19.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 71.14 111.463 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.824 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -77.6 156.8 30.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.026 0.441 . . . . 72.14 111.23 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.31 -122.27 5.39 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 115.646 -0.707 . . . . 73.33 112.489 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.846 ' O ' HG23 ' A' ' 50' ' ' VAL . 4.8 m120 -116.3 117.76 30.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.814 0.34 . . . . 74.44 110.964 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.665 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.97 -54.96 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.186 -0.461 . . . . 73.24 111.414 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.2 -37.81 16.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.9 -0.591 . . . . 45.33 111.075 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -85.77 -25.58 26.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.009 -0.541 . . . . 70.33 111.13 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.846 HG23 ' O ' ' A' ' 46' ' ' ASN . 25.1 t -82.35 -25.82 8.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 75.41 111.423 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.21 -15.78 63.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.815 0.341 . . . . 71.14 111.189 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.12 -32.36 13.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 75.55 110.914 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.0 m -88.82 -33.6 17.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.326 -0.397 . . . . 73.53 111.053 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -91.96 125.34 36.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 71.03 111.191 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -82.09 175.83 10.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 73.11 110.602 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.532 ' O ' HG23 ' A' ' 60' ' ' VAL . 6.9 tptt -58.42 -58.18 9.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.857 0.36 . . . . 73.54 110.587 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.0 -26.67 68.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.083 -0.508 . . . . 65.4 110.503 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -42.85 99.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.128 -0.487 . . . . 72.21 110.376 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.673 HD21 HG12 ' A' ' 26' ' ' ILE . 19.3 mt -71.6 -32.75 68.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.69 -0.686 . . . . 74.31 110.928 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.899 HG11 ' HD2' ' A' ' 16' ' ' ARG . 13.0 t -78.43 -42.29 26.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 52.24 110.94 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.3 m -59.41 -36.94 76.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.964 -0.562 . . . . 74.35 110.64 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.465 ' HB3' HD11 ' A' ' 43' ' ' LEU . . . -80.75 -22.17 40.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.019 -0.537 . . . . 75.11 110.999 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.647 ' HA ' HD21 ' A' ' 29' ' ' LEU . 21.6 t80 -83.78 -22.85 31.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 71.42 111.026 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.475 ' ND2' HG12 ' A' ' 60' ' ' VAL . 16.8 m-80 -83.09 -54.73 4.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.279 -0.419 . . . . 74.35 111.545 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.501 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 4.2 p-80 -61.7 -29.13 69.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.098 -0.501 . . . . 71.0 111.366 -179.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.603 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.0 tt -51.98 -39.27 59.09 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.901 0.381 . . . . 74.24 111.118 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -78.81 -36.53 42.54 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.068 -0.514 . . . . 70.52 110.608 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.97 -39.87 83.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.961 -0.563 . . . . 61.53 110.745 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.68 -3.52 52.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.978 -0.556 . . . . 72.02 111.359 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.641 ' HE2' HG21 ' A' ' 136' ' ' THR . 8.3 mmtp 48.5 38.97 11.99 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.752 0.31 . . . . 75.41 111.316 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -93.85 43.5 1.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.379 . . . . 64.05 111.111 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.552 ' HA ' HD21 ' A' ' 66' ' ' LEU . 86.4 m-85 -66.3 179.61 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.434 . . . . 74.34 110.889 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.9 tttt -75.15 153.01 38.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 72.41 110.893 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -120.87 -86.31 0.9 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.775 -0.726 . . . . 50.33 112.436 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -157.23 110.43 2.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.824 0.345 . . . . 63.14 110.944 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -141.57 148.64 39.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 72.32 110.896 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.533 ' O ' HG23 ' A' ' 78' ' ' ILE . 1.4 t 60.28 73.32 0.49 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.129 -0.487 . . . . 62.54 110.939 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.533 HG23 ' O ' ' A' ' 77' ' ' SER . 7.1 pt -158.76 158.34 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.491 . . . . 73.52 111.144 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.65 89.11 5.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 75.44 110.875 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -81.26 146.46 30.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.182 -0.463 . . . . 74.44 110.891 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.2 m -112.41 144.69 19.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.146 -0.479 . . . . 52.33 111.111 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.9 t -114.03 -66.37 1.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.183 -0.462 . . . . 73.54 110.923 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -70.21 132.61 46.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 72.34 110.857 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -108.1 -31.47 7.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 62.04 110.902 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.7 p -115.67 147.0 19.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 72.33 111.075 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.0 mtmt -106.57 -177.07 3.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 64.13 110.906 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -60.38 -179.77 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 63.03 110.868 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.5 t 63.5 109.08 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 53.43 111.138 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.9 tttp -70.04 84.99 0.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 71.43 110.884 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.1 tp -145.44 137.02 25.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 74.25 110.897 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -83.25 124.49 30.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 71.32 110.902 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -102.59 160.19 14.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.454 . . . . 74.44 110.927 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -127.06 138.48 53.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 71.24 110.872 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 28.5 mttm 60.22 85.41 0.18 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 75.24 110.872 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.87 147.02 61.25 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.54 2.16 . . . . 63.4 112.302 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -136.91 128.09 27.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 73.23 110.872 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -133.03 -76.68 0.49 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.467 . . . . 73.5 110.879 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 3.1 t -175.0 -40.38 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.966 -0.561 . . . . 72.24 110.878 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 2.7 tmtp? -92.76 110.18 21.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.105 -0.498 . . . . 74.1 110.906 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.6 p -138.42 152.6 48.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 72.11 110.895 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -160.28 35.5 0.17 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 54.4 110.929 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -81.03 138.5 36.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 74.42 110.927 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 58.2 p -140.73 147.92 39.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.434 . . . . 61.13 110.905 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.458 ' HA ' HD22 ' A' ' 104' ' ' LEU . 0.2 OUTLIER -103.01 -36.93 8.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 73.03 110.905 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 59.31 -174.28 0.1 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.078 -0.51 . . . . 72.34 110.948 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -97.38 -32.98 11.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 62.41 110.873 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 164.43 62.31 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.725 -0.75 . . . . 73.12 112.468 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.9 168.01 24.29 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.565 2.177 . . . . 62.13 112.279 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.96 -168.01 0.26 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.58 2.187 . . . . 61.25 112.319 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -104.65 36.8 2.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 74.43 110.819 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -165.66 163.95 19.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 70.12 110.807 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.413 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 33.3 m -128.33 129.0 45.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.469 . . . . 75.4 110.668 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.708 ' HD2' ' HB1' ' A' ' 178' ' ' ALA . 8.0 tttm -128.88 151.47 49.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.31 -0.405 . . . . 61.53 110.972 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.407 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.4 m -150.27 123.14 8.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 60.24 110.872 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 29.8 t -80.37 106.33 11.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 73.24 111.454 -179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.407 HD12 ' O ' ' A' ' 114' ' ' SER . 7.5 mp -76.46 -59.99 2.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.143 -0.48 . . . . 63.34 110.497 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -112.94 108.05 16.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.93 -0.577 . . . . 62.01 110.681 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.8 mtmp? -60.97 142.86 56.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 70.43 110.969 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.404 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -110.44 -159.04 16.72 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.773 -0.727 . . . . 65.32 112.211 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -35.03 -46.71 0.33 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.814 0.34 . . . . 63.1 111.654 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.626 ' O ' HG23 ' A' ' 122' ' ' THR . 0.5 OUTLIER 72.6 39.21 0.72 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 73.41 110.3 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.626 HG23 ' O ' ' A' ' 121' ' ' LYS . 0.8 OUTLIER -167.71 -42.68 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.686 -0.688 . . . . 71.41 110.423 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -84.71 86.4 7.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.018 -0.537 . . . . 75.13 110.669 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -106.0 155.54 38.23 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.044 -0.525 . . . . 64.34 110.822 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.6 ' HB2' HG21 ' A' ' 166' ' ' VAL . 56.0 Cg_endo -70.25 125.53 11.99 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.537 2.158 . . . . 50.54 112.469 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.25 155.66 17.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.095 -0.502 . . . . 74.25 110.867 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 1.1 tptm -56.92 119.23 5.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 75.51 110.945 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 94.44 -9.41 71.73 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.721 -0.752 . . . . 74.01 112.758 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.27 140.15 29.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.871 0.367 . . . . 62.53 110.995 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.69 HG12 ' O ' ' A' ' 224' ' ' ASP . 7.3 p -70.86 162.44 4.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.107 -0.497 . . . . 70.03 111.014 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.743 HG22 ' O ' ' A' ' 164' ' ' PHE . 4.4 m -153.59 144.98 14.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.137 -0.483 . . . . 64.54 111.009 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.451 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.87 117.84 22.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.738 0.304 . . . . 73.41 110.763 179.528 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.735 ' HB3' HD22 ' A' ' 220' ' ' LEU . 30.3 p -150.21 168.94 22.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.077 0.465 . . . . 54.44 111.102 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.838 ' HB3' HD11 ' A' ' 149' ' ' ILE . 80.6 m95 -102.64 157.52 16.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.729 -0.669 . . . . 64.14 110.015 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 53.2 p90 -162.23 138.73 7.86 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.148 0.499 . . . . 72.43 112.055 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.679 HG21 HG11 ' A' ' 5' ' ' VAL . 22.1 m -131.35 116.23 17.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.478 -0.783 . . . . 73.24 110.335 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.599 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -98.16 145.17 17.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.601 -0.809 . . . . 63.12 113.291 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.702 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.1 OUTLIER -147.9 143.24 27.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.832 0.349 . . . . 62.34 110.75 179.756 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.788 ' O ' ' HB2' ' A' ' 3' ' ' ALA . 90.7 mt -88.64 -179.53 6.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 73.33 110.756 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -52.88 -45.14 67.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.301 -0.409 . . . . 74.01 111.075 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.0 -13.22 62.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.974 -0.557 . . . . 74.01 111.326 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 88.27 25.85 29.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.651 -0.785 . . . . 64.45 112.59 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -98.27 124.88 43.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.815 0.341 . . . . 74.21 110.817 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.2 t -63.7 129.41 27.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 62.23 111.085 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.43 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 54.1 p90 -110.83 -33.65 6.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 73.24 111.012 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . 0.41 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 13.9 m-20 -162.53 110.27 1.32 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 75.42 110.949 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 9.2 t -142.91 127.68 18.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 71.44 110.951 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 34.2 p-10 -92.71 52.58 1.89 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 73.23 110.385 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.838 HD11 ' HB3' ' A' ' 134' ' ' TRP . 27.9 mm -125.1 102.31 10.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.064 -0.516 . . . . 65.53 110.886 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -96.51 -75.69 0.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 74.11 110.943 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 69.4 p -146.37 165.99 27.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 54.44 110.93 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.12 -178.78 6.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.125 -0.489 . . . . 62.12 110.877 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -80.86 -29.06 35.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 53.35 111.142 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.513 ' HG2' HG21 ' A' ' 12' ' ' VAL . 0.7 OUTLIER -58.67 -31.33 68.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.436 . . . . 71.12 110.989 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.12 -63.07 1.25 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 74.23 110.966 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 3.5 pttt -172.43 152.36 2.67 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.846 -0.615 . . . . 73.02 110.898 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 7.8 mmtp -66.18 78.26 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 65.24 110.894 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -153.37 43.15 0.59 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.479 . . . . 64.24 110.88 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.12 127.72 6.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 73.12 111.08 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.25 146.45 36.47 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 65.03 110.819 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.42 155.84 68.66 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.538 2.159 . . . . 72.33 112.234 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.417 ' O ' HD23 ' A' ' 162' ' ' LEU . 3.6 tt -75.44 121.44 22.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.31 -0.404 . . . . 73.32 110.576 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.621 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.67 122.29 42.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.946 0.403 . . . . 73.13 111.305 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.743 ' O ' HG22 ' A' ' 131' ' ' VAL . 10.8 p90 -151.81 143.67 23.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.909 -0.587 . . . . 72.34 110.557 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.581 ' O ' HG22 ' A' ' 168' ' ' VAL . 4.6 mttp -80.96 138.71 36.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.079 0.466 . . . . 73.24 111.323 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.6 HG21 ' HB2' ' A' ' 125' ' ' PRO . 35.8 m -87.38 149.42 4.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.618 -0.719 . . . . 71.52 111.188 -179.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.77 21.71 78.86 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.805 -0.712 . . . . 53.23 112.637 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.745 HG23 ' HG2' ' A' ' 170' ' ' LYS . 29.3 m -130.16 41.15 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.871 0.367 . . . . 74.13 111.134 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.47 38.58 5.34 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 121.125 -0.56 . . . . 74.23 113.154 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . 0.745 ' HG2' HG23 ' A' ' 168' ' ' VAL . 0.4 OUTLIER -84.69 -41.86 15.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.865 0.364 . . . . 72.35 110.95 -179.945 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.7 m -121.95 179.78 2.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.112 -0.494 . . . . 54.24 110.994 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.539 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -59.88 159.48 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.331 -0.395 . . . . 75.44 111.158 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -67.72 -28.26 67.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.204 -0.453 . . . . 72.03 111.139 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.5 -37.58 46.43 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.668 -0.777 . . . . 61.32 111.958 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.714 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.3 t90 -78.33 -33.48 49.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.919 0.39 . . . . 62.43 110.998 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . 0.697 ' O ' HD13 ' A' ' 180' ' ' LEU . 38.9 t70 -64.31 -33.87 76.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.967 -0.561 . . . . 75.33 110.444 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -78.65 -29.71 45.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 71.4 110.662 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.708 ' HB1' ' HD2' ' A' ' 113' ' ' LYS . . . -81.16 -45.47 16.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 50.21 111.105 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.62 HD21 ' NE1' ' A' ' 175' ' ' TRP . 11.8 mt -72.39 -18.92 61.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.016 -0.538 . . . . 74.25 111.167 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.697 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.3 tp -56.38 -24.18 42.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.429 -0.351 . . . . 72.54 111.345 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 16.2 p -114.5 18.09 16.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.627 -0.26 . . . . 75.3 111.618 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 3.5 mmm -68.13 103.48 1.56 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.869 0.366 . . . . 73.02 110.913 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.22 148.99 49.06 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.195 -0.457 . . . . 75.13 110.839 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 3.2 ttmt -54.85 115.77 2.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.506 . . . . 70.31 111.216 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 77.39 20.05 75.48 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.921 -0.656 . . . . 60.02 113.201 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . 0.404 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.6 tt0 -93.69 146.48 23.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.867 0.333 . . . . 73.3 111.032 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -119.22 136.23 54.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 73.24 109.936 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -150.57 176.25 11.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.106 0.479 . . . . 63.34 111.831 -179.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.88 133.52 33.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.604 -0.726 . . . . 73.22 109.477 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.701 HD11 ' CD1' ' A' ' 175' ' ' TRP . 1.6 pt? -140.07 141.53 36.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.135 0.493 . . . . 74.45 112.109 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.828 ' HG3' HG23 ' A' ' 215' ' ' THR . 2.5 mp0 -116.94 112.39 20.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.549 -0.75 . . . . 64.22 110.021 179.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.58 HD11 HD12 ' A' ' 190' ' ' LEU . 1.3 mm -92.18 150.26 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.922 0.391 . . . . 73.35 111.214 -179.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -83.37 166.4 35.04 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.044 -0.525 . . . . 72.53 110.69 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . 0.402 ' CB ' ' HA ' ' A' ' 211' ' ' ASN . 40.1 Cg_endo -66.91 -14.76 44.95 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.532 2.155 . . . . 73.1 112.6 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -84.23 -31.18 25.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 62.13 111.034 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.435 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 14.4 m0 -107.54 37.03 2.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.416 . . . . 74.02 111.075 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -154.44 -81.06 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 64.41 111.087 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . 0.582 ' CE2' HD11 ' A' ' 214' ' ' LEU . 41.7 m-85 -106.11 -71.31 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.033 0.444 . . . . 74.13 110.762 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 151.34 176.56 24.28 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.721 -0.752 . . . . 43.32 112.597 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.31 -30.01 36.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.857 0.36 . . . . 74.42 110.798 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -49.73 19.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 70.31 110.686 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 107.35 -128.22 9.13 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.836 -0.697 . . . . 53.02 112.536 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.732 ' CB ' HD12 ' A' ' 208' ' ' ILE . 0.0 OUTLIER -156.69 82.34 3.34 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 120.871 0.367 . . . . 71.43 110.753 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.57 -24.57 29.51 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.634 2.223 . . . . 71.3 112.481 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.42 -42.02 96.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.845 0.355 . . . . 75.41 111.027 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -103.53 28.83 6.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 70.25 111.257 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.43 29.8 15.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.268 -0.424 . . . . 73.43 111.023 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.778 HG12 HD11 ' A' ' 139' ' ' LEU . 40.2 mt -90.49 111.68 48.77 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.219 -0.446 . . . . 71.23 111.07 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.21 170.89 19.14 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.527 2.151 . . . . 73.11 112.429 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.7 142.15 96.99 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.641 2.228 . . . . 71.13 112.177 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . 0.402 ' HA ' ' CB ' ' A' ' 194' ' ' PRO . 57.5 m-80 47.82 76.67 0.11 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.356 -0.384 . . . . 70.2 111.116 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.08 113.56 17.91 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.357 -0.383 . . . . 70.12 111.581 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.57 126.84 29.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.134 -0.485 . . . . 41.33 110.253 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.582 HD11 ' CE2' ' A' ' 198' ' ' TYR . 13.0 mt -103.35 109.45 21.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.851 0.358 . . . . 72.13 111.556 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.828 HG23 ' HG3' ' A' ' 191' ' ' GLU . 20.5 m -103.26 136.85 42.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 62.4 110.617 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.627 ' CE1' HD21 ' A' ' 190' ' ' LEU . 29.3 p90 -155.38 176.3 12.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.061 0.458 . . . . 64.35 111.539 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -131.63 135.29 46.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.707 -0.679 . . . . 75.43 110.612 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.714 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.3 t -121.95 149.99 25.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.11 0.481 . . . . 73.41 111.924 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -136.91 110.46 8.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.737 -0.665 . . . . 72.4 110.453 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.735 HD22 ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.93 130.76 43.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.345 . . . . 70.22 110.897 -179.664 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.415 HG23 ' HA ' ' A' ' 133' ' ' CYS . 18.3 t -110.25 -30.13 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.221 -0.445 . . . . 52.25 111.633 -179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -168.86 158.61 8.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.865 0.364 . . . . 62.42 111.069 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.668 HG23 HG12 ' A' ' 131' ' ' VAL . 3.4 mp -142.12 112.12 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 63.32 111.097 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . 0.69 ' O ' HG12 ' A' ' 130' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-O 121.073 0.463 . . . . 73.15 110.826 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.7 mtt . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.851 0.357 . . . . 54.0 111.17 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.23 175.47 0.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 52.23 111.09 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -174.25 40.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 51.24 111.114 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -81.63 172.82 12.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 63.22 111.08 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 1.043 HG11 HG21 ' A' ' 136' ' ' THR . 33.2 t -60.04 110.81 3.14 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.139 -0.482 . . . . 64.44 111.044 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.423 ' HD2' ' CD2' ' A' ' 72' ' ' PHE . 92.4 Cg_endo -78.98 139.56 15.36 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.607 2.205 . . . . 71.4 112.428 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -80.62 151.87 28.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.168 -0.469 . . . . 51.22 110.827 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.82 92.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.2 -0.455 . . . . 73.54 111.299 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.89 -35.45 76.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 71.05 111.027 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 2.4 m-90 -114.62 173.68 6.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.087 -0.506 . . . . 72.33 110.866 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.449 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -118.25 154.33 32.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.081 -0.509 . . . . 72.32 110.644 179.774 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.51 HG12 ' HD2' ' A' ' 16' ' ' ARG . 43.7 t -55.13 -34.28 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.353 -0.385 . . . . 51.24 110.927 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -65.01 -32.38 74.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.108 -0.496 . . . . 72.51 110.839 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.449 ' HB2' HG23 ' A' ' 11' ' ' THR . 1.4 tp-100 -82.05 -56.1 4.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.346 -0.388 . . . . 73.24 110.835 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.82 ' HB3' HG22 ' A' ' 60' ' ' VAL . 8.3 mt -50.21 -28.75 8.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.202 -0.454 . . . . 64.32 110.82 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.51 ' HD2' HG12 ' A' ' 12' ' ' VAL . 60.6 mtt180 -94.63 -28.7 15.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.766 -0.652 . . . . 72.43 110.337 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.4 t -53.12 170.2 0.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.881 -0.6 . . . . 64.11 111.314 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -103.69 17.11 24.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.733 -0.667 . . . . 73.33 111.123 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -113.65 -20.66 11.12 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.489 -0.323 . . . . 72.2 111.357 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.649 HD23 ' N ' ' A' ' 21' ' ' PRO . 6.2 tt -84.78 129.48 56.61 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.591 -0.277 . . . . 73.43 110.959 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.649 ' N ' HD23 ' A' ' 20' ' ' LEU . 73.6 Cg_endo -77.23 125.64 7.97 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.5 2.133 . . . . 55.51 112.255 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -24.1 66.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 70.34 110.952 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.428 ' HA ' HD12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -54.26 -35.21 62.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.282 -0.417 . . . . 62.44 111.465 -179.751 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.26 -54.48 6.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.966 0.413 . . . . 64.25 111.046 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.673 ' O ' HD12 ' A' ' 29' ' ' LEU . 29.1 mt -45.0 -32.9 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 64.04 111.38 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.641 HG12 HD21 ' A' ' 59' ' ' LEU . 6.1 mt -76.51 -49.97 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 54.04 110.925 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.42 ' HE2' HD13 ' A' ' 47' ' ' ILE . 34.8 mttm -64.8 -25.57 67.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.812 -0.631 . . . . 72.44 111.115 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -70.4 -45.38 66.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.997 0.427 . . . . 75.24 110.834 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.764 HD21 ' HA ' ' A' ' 63' ' ' TYR . 3.4 mt -69.97 -36.48 75.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.851 -0.613 . . . . 65.53 110.946 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.495 ' HA ' HD11 ' A' ' 38' ' ' LEU . 38.5 mt-30 -69.59 -20.72 63.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.176 -0.465 . . . . 72.45 110.707 179.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.2 -51.06 5.35 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.148 -0.478 . . . . 72.34 110.963 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -88.87 0.91 56.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.254 -0.43 . . . . 71.52 111.612 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.38 160.45 14.33 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.673 -0.775 . . . . 64.24 112.445 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -92.55 151.87 19.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.547 0.213 . . . . 71.24 110.458 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.685 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -48.94 -57.12 6.98 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.81 0.338 . . . . 54.44 111.176 -179.745 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -47.78 -51.65 21.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.059 0.457 . . . . 61.22 110.842 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.508 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 10.8 t80 -52.76 -47.51 67.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.82 -0.627 . . . . 62.51 110.477 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.495 HD11 ' HA ' ' A' ' 30' ' ' GLN . 11.2 mt -66.32 -40.88 90.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.073 -0.512 . . . . 64.45 110.764 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.804 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.83 -47.51 31.3 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.056 0.455 . . . . 71.13 111.079 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -57.64 -26.91 62.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.765 -0.652 . . . . 74.03 110.895 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 43.9 m-70 -112.63 11.16 19.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.276 -0.42 . . . . 75.12 111.261 179.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt 51.15 35.47 13.3 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.858 0.361 . . . . 64.13 110.93 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.652 HD13 HD13 ' A' ' 29' ' ' LEU . 29.1 mt -94.18 -20.34 19.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.132 -0.485 . . . . 73.45 111.736 -179.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.804 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.69 158.76 26.89 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.046 0.45 . . . . 63.32 111.121 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 114.57 -119.37 4.67 Favored Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 115.798 -0.637 . . . . 75.24 112.404 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.747 ' O ' HG23 ' A' ' 50' ' ' VAL . 5.6 m120 -116.34 113.79 23.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.751 0.31 . . . . 70.13 110.9 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.617 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -45.58 -54.64 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.192 -0.458 . . . . 74.42 111.374 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.27 -36.55 9.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.87 -0.605 . . . . 71.42 110.92 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -85.64 -25.23 26.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.992 -0.549 . . . . 74.21 111.102 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.747 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.7 t -83.45 -25.81 7.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.297 -0.41 . . . . 70.34 111.479 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.0 -15.83 63.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.37 -0.377 . . . . 65.11 111.41 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -95.19 -34.02 12.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.818 0.342 . . . . 73.3 110.999 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.623 HG22 ' HA ' ' A' ' 50' ' ' VAL . 9.8 t -87.94 -30.56 19.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.46 . . . . 65.51 111.081 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -92.45 125.8 37.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.427 . . . . 73.32 111.132 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.09 174.84 10.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 71.25 110.642 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.627 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -57.77 -58.1 9.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.861 0.363 . . . . 62.43 110.505 179.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.59 -26.99 68.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.121 -0.491 . . . . 75.34 110.573 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.91 -43.4 98.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.095 -0.502 . . . . 70.44 110.475 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.641 HD21 HG12 ' A' ' 26' ' ' ILE . 20.4 mt -73.48 -32.64 64.41 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.713 -0.676 . . . . 73.41 110.973 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.82 HG22 ' HB3' ' A' ' 15' ' ' LEU . 15.9 t -76.9 -42.39 32.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.005 0.431 . . . . 74.11 110.695 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.0 m -60.73 -33.44 72.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.869 -0.605 . . . . 73.34 110.516 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.445 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -81.13 -22.25 39.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.483 . . . . 75.32 111.045 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.764 ' HA ' HD21 ' A' ' 29' ' ' LEU . 14.0 t80 -83.66 -22.9 32.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.099 -0.5 . . . . 73.11 111.126 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -83.95 -54.16 5.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.046 0.45 . . . . 71.22 111.294 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.585 ' HD2' HG21 ' A' ' 69' ' ' THR . 3.1 p-80 -60.78 -31.09 70.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.02 -0.536 . . . . 65.11 111.036 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.648 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.7 tt -46.1 -41.12 11.89 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.899 0.381 . . . . 63.2 111.162 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -78.13 -42.14 32.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.018 -0.537 . . . . 72.34 110.268 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -70.03 -13.07 62.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.853 -0.612 . . . . 70.05 110.933 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.585 HG21 ' HD2' ' A' ' 65' ' ' HIS . 35.8 p -108.72 -16.07 14.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.179 -0.464 . . . . 51.13 111.195 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.29 30.65 17.11 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.793 0.33 . . . . 72.12 110.942 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -96.1 44.27 1.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 74.44 111.047 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.423 ' CD2' ' HD2' ' A' ' 6' ' ' PRO . 75.5 m-85 -66.86 175.95 2.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 65.12 110.696 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.36 147.45 44.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 72.23 110.879 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 164.18 148.37 5.41 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.696 -0.764 . . . . 62.11 112.514 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.6 p 56.29 103.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.859 0.361 . . . . 64.34 111.007 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -176.94 -39.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 71.32 110.935 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.92 134.83 6.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.097 -0.501 . . . . 71.34 110.926 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 23.9 mt -112.56 151.81 14.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 75.53 111.102 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.5 m -72.56 126.52 30.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 42.42 110.911 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.85 148.97 29.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 71.33 110.903 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -85.6 129.07 38.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 52.22 111.135 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.7 m -103.09 144.17 31.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 42.42 110.924 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.56 148.7 27.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.155 -0.475 . . . . 74.25 110.883 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 60.46 110.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 61.34 110.925 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 27.7 t -108.19 145.48 15.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 74.11 111.068 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -74.26 -55.78 5.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 61.24 110.888 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.577 ' OD1' HD22 ' A' ' 90' ' ' LEU . 23.3 m-20 -87.92 141.62 28.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 71.4 110.887 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.3 m -107.73 108.41 25.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 61.52 111.136 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.64 34.6 20.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 75.31 110.929 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.577 HD22 ' OD1' ' A' ' 87' ' ' ASN . 1.1 tp -108.98 143.6 38.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 73.31 110.927 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 60.8 111.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 72.32 110.92 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -104.22 159.51 15.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 70.22 110.913 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -177.56 -39.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 75.34 110.94 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.3 tptt -162.55 79.93 1.8 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.083 -0.508 . . . . 74.22 110.877 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -52.23 121.47 8.97 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.587 2.191 . . . . 51.1 112.356 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 62.0 151.29 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 75.31 110.929 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -109.98 -32.12 7.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 71.32 110.873 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.0 t 43.43 69.37 0.41 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.159 -0.473 . . . . 72.33 111.474 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -84.13 118.74 24.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 73.15 110.908 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 83.6 p -151.0 -175.41 5.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 65.24 110.932 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -143.91 35.49 1.26 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.223 -0.444 . . . . 72.03 110.905 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -146.14 101.92 3.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 63.21 110.914 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 69.9 p -110.11 -32.88 6.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 74.31 110.937 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.4 mp -108.32 151.07 26.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 65.34 110.868 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -137.89 31.27 2.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 75.31 110.917 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -110.58 -32.32 6.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 64.1 110.918 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 136.44 69.99 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.727 -0.749 . . . . 74.42 112.502 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.77 154.59 67.52 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.591 2.194 . . . . 71.51 112.324 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.448 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 55.8 Cg_endo -70.16 -166.78 0.21 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.565 2.177 . . . . 74.1 112.284 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.439 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -97.66 30.61 2.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.274 -0.421 . . . . 72.54 110.987 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.448 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 31.7 p90 -152.36 171.5 17.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.307 -0.406 . . . . 73.1 110.88 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.415 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 0.2 OUTLIER -134.52 129.22 34.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 75.41 110.56 179.828 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.41 ' CG ' ' HB3' ' A' ' 190' ' ' LEU . 0.0 OUTLIER -120.32 151.54 39.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 62.41 111.056 -179.776 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.401 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.3 m -150.08 114.1 5.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.144 -0.48 . . . . 71.44 110.875 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.61 ' O ' HG13 ' A' ' 115' ' ' VAL . 9.7 p -80.7 106.6 12.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.249 -0.432 . . . . 75.35 111.134 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.401 HD12 ' O ' ' A' ' 114' ' ' SER . 6.4 mp -78.31 -77.11 0.17 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.476 . . . . 61.51 111.076 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -96.76 110.0 22.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.267 -0.424 . . . . 74.11 111.08 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.2 mtmt -59.43 139.6 56.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 64.32 110.804 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.514 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -111.68 -154.78 12.88 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.682 -0.77 . . . . 24.21 112.659 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -37.29 -52.92 1.09 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.049 0.452 . . . . 44.51 111.412 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 tmtp? 71.85 36.17 1.24 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.793 -0.64 . . . . 71.42 110.234 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -156.91 -44.61 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.791 -0.64 . . . . 73.35 110.775 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -87.59 97.08 10.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.117 -0.492 . . . . 72.53 110.919 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -109.41 154.82 42.04 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.089 -0.505 . . . . 75.13 110.642 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.69 ' HB2' HG21 ' A' ' 166' ' ' VAL . 58.5 Cg_endo -71.59 125.47 11.2 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.515 2.143 . . . . 65.33 112.439 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.1 tttm -92.99 160.22 14.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 75.22 110.899 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -57.89 119.47 6.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.286 -0.415 . . . . 72.14 110.947 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 87.45 1.8 83.21 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.745 -0.74 . . . . 75.11 112.833 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -92.13 139.41 30.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.878 0.37 . . . . 74.33 110.967 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.524 HG22 ' N ' ' A' ' 131' ' ' VAL . 4.4 p -71.66 162.04 4.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.066 -0.515 . . . . 75.03 110.909 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.699 HG12 HG23 ' A' ' 223' ' ' ILE . 9.3 m -154.56 145.58 13.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.042 -0.526 . . . . 52.02 110.987 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.452 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -128.35 117.95 22.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.728 0.299 . . . . 75.05 110.936 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.455 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 29.1 p -154.26 170.3 21.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.919 0.39 . . . . 33.5 111.196 -179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.61 ' HB3' HD11 ' A' ' 149' ' ' ILE . 66.3 m95 -104.19 161.01 14.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.938 -0.574 . . . . 74.52 110.149 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.506 ' OH ' HD13 ' A' ' 162' ' ' LEU . 4.5 p90 -159.5 134.98 8.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.03 0.443 . . . . 73.42 111.702 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 1.043 HG21 HG11 ' A' ' 5' ' ' VAL . 22.5 m -127.83 113.55 16.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 70.52 110.307 179.467 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.601 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.18 144.2 17.06 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.629 -0.796 . . . . 53.53 113.342 -179.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.84 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.44 130.77 13.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.756 0.312 . . . . 62.14 110.457 179.675 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.66 HD21 HG23 ' A' ' 208' ' ' ILE . 91.3 mt -66.02 -178.0 0.56 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.395 -0.366 . . . . 70.13 110.849 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -56.7 -42.3 78.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 75.33 110.76 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.46 -5.22 56.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.97 -0.559 . . . . 73.11 111.395 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 95.89 25.76 12.62 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.624 -0.798 . . . . 65.12 112.634 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . 0.645 ' HB ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -80.89 113.02 18.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.876 0.37 . . . . 72.1 110.837 180.0 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.479 ' CG2' HG23 ' A' ' 147' ' ' THR . 11.3 p -71.6 121.42 21.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 73.42 111.136 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.442 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 53.3 p90 -113.28 -17.08 12.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 50.33 111.315 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -156.09 127.52 7.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.797 0.332 . . . . 73.42 110.951 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.874 HG22 HG23 ' A' ' 136' ' ' THR . 1.0 OUTLIER -142.87 98.01 3.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 73.22 111.005 -179.992 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -77.26 -9.16 58.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.224 -0.444 . . . . 73.52 111.075 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.693 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.5 mp -94.54 117.76 39.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.383 -0.371 . . . . 51.32 110.962 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -106.06 -73.38 0.68 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.455 . . . . 72.1 110.89 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 4.1 m -145.53 166.01 26.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 55.13 110.902 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 94.4 p -77.2 166.45 23.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 72.42 110.92 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.0 -31.01 34.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 73.43 111.123 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 13.0 mmmt -59.94 -31.49 69.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 65.04 110.969 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 2.5 tptp -88.67 -33.58 17.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.462 . . . . 75.31 110.895 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -176.83 148.57 0.68 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 72.24 110.855 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -88.63 89.63 8.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 73.41 110.923 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 58.8 m-20 -158.83 45.99 0.3 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 73.41 110.831 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.11 114.43 3.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 74.41 111.092 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -129.83 128.4 22.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 74.22 110.89 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.09 148.2 40.65 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.411 2.074 . . . . 74.2 112.314 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.506 HD13 ' OH ' ' A' ' 135' ' ' TYR . 0.3 OUTLIER -73.47 120.76 19.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 50.54 110.532 179.797 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.644 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -103.55 122.7 45.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.944 0.402 . . . . 64.34 111.336 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.655 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 25.2 p90 -153.74 145.58 23.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.002 -0.544 . . . . 74.44 110.637 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.452 ' HB3' HG21 ' A' ' 168' ' ' VAL . 60.9 mttt -80.75 138.49 36.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.128 0.489 . . . . 73.3 111.29 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.69 HG21 ' HB2' ' A' ' 125' ' ' PRO . 17.8 m -87.27 149.35 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.652 -0.704 . . . . 73.24 111.05 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.0 23.7 76.91 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.777 -0.725 . . . . 73.22 112.408 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.452 HG21 ' HB3' ' A' ' 165' ' ' LYS . 0.8 OUTLIER -132.55 39.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.939 0.4 . . . . 62.32 110.926 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 47.36 38.77 13.34 Favored Glycine 0 C--N 1.33 0.202 0 C-N-CA 121.02 -0.609 . . . . 61.22 112.85 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.5 -47.05 11.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.915 0.388 . . . . 72.4 110.872 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . 0.466 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.2 OUTLIER -120.08 -179.68 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.96 -0.564 . . . . 74.35 111.022 179.898 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.522 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 4.0 pt -59.64 161.02 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.32 -0.4 . . . . 73.22 111.285 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -69.07 -27.88 66.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 75.2 110.986 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.83 -37.75 38.29 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.673 -0.775 . . . . 62.3 112.03 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.695 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.7 t90 -78.44 -33.43 48.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.921 0.391 . . . . 74.44 111.09 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -69.05 -29.05 67.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.973 -0.558 . . . . 64.41 110.695 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -81.76 -28.72 33.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 75.42 110.827 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.568 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -85.27 -51.55 6.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.277 -0.42 . . . . 73.24 111.212 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.655 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 2.9 mt -54.39 -36.71 64.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.991 -0.55 . . . . 75.12 110.773 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 3.1 tp -54.15 -25.02 20.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 70.24 110.996 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.16 -0.0 57.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 60.11 111.445 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 23.2 mmm -80.54 150.14 29.7 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.867 0.365 . . . . 55.31 110.909 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.52 171.08 8.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.104 -0.498 . . . . 71.31 111.18 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . 0.511 ' HA ' HD22 ' A' ' 220' ' ' LEU . 3.6 tttt -62.7 117.1 5.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.037 -0.529 . . . . 63.13 110.68 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . 0.401 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 69.07 65.63 2.54 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.617 -0.802 . . . . 72.41 112.398 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . 0.514 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.5 tt0 -145.05 145.14 31.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.663 0.268 . . . . 63.0 110.503 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.9 ttpt -118.36 135.88 54.06 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 110.194 -0.299 . . . . 70.34 110.194 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -144.43 172.82 12.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.125 0.488 . . . . 73.31 111.864 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.52 118.22 14.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.53 -0.759 . . . . 71.53 109.817 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.696 HD21 ' CE1' ' A' ' 216' ' ' PHE . 2.1 pt? -128.73 139.84 52.02 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.016 0.436 . . . . 65.24 111.795 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.559 ' HB3' HG23 ' A' ' 215' ' ' THR . 0.0 OUTLIER -117.79 114.87 23.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.792 -0.64 . . . . 75.24 110.544 179.549 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.449 HD13 HD11 ' A' ' 172' ' ' ILE . 3.1 mt -105.0 142.43 18.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.229 -0.441 . . . . 61.25 111.521 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.433 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.3 OUTLIER -72.05 168.57 21.78 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.907 -0.588 . . . . 74.25 110.592 179.818 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . 0.433 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 24.7 Cg_endo -61.93 -35.07 79.56 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.352 2.035 . . . . 61.03 112.224 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -60.37 -39.91 88.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 71.12 111.099 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.439 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 16.8 m0 -96.98 36.87 1.36 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.343 -0.39 . . . . 64.0 110.974 -179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -160.8 -78.45 0.05 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.067 -0.515 . . . . 61.34 110.742 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . 0.589 ' CE2' HD13 ' A' ' 208' ' ' ILE . 36.0 m-85 -105.98 -71.25 0.75 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 74.34 110.535 179.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 141.03 -177.21 21.11 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.815 -0.707 . . . . 32.35 112.85 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 18.4 mttm -59.21 -34.65 72.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.816 0.341 . . . . 72.43 110.932 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -61.57 -52.8 62.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.146 -0.479 . . . . 50.02 110.64 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 97.17 173.6 34.29 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.874 -0.679 . . . . 73.22 112.551 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.425 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.3 OUTLIER -111.23 93.51 18.61 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.654 0.264 . . . . 75.14 110.743 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.97 -26.37 51.32 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.527 2.151 . . . . 64.43 112.443 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -60.86 -42.18 97.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.946 0.403 . . . . 74.43 110.849 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -99.21 27.43 5.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.043 -0.526 . . . . 75.34 111.231 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.1 29.44 14.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.27 -0.423 . . . . 74.02 111.038 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.66 HG23 HD21 ' A' ' 139' ' ' LEU . 40.6 mt -94.14 111.46 53.39 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.317 -0.401 . . . . 62.52 110.987 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.33 172.32 6.65 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.554 2.169 . . . . 74.21 112.25 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -74.2 128.64 12.31 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.612 2.208 . . . . 72.33 112.241 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 63.26 69.54 0.57 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.3 -0.409 . . . . 53.14 110.711 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.68 156.98 34.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 43.13 111.39 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -88.57 141.72 28.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.962 -0.563 . . . . 53.33 110.381 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.457 HD11 ' CD2' ' A' ' 198' ' ' TYR . 3.5 mt -125.68 109.07 12.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.379 . . . . 70.33 111.518 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.559 HG23 ' HB3' ' A' ' 191' ' ' GLU . 4.3 m -113.07 142.9 45.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.953 -0.567 . . . . 44.42 110.511 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.696 ' CE1' HD21 ' A' ' 190' ' ' LEU . 18.4 p90 -155.08 -179.86 8.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.438 . . . . 74.54 111.371 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -132.53 135.96 46.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.702 -0.681 . . . . 73.4 110.409 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.695 HG21 ' HE1' ' A' ' 175' ' ' TRP . 4.2 t -121.14 150.9 24.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.098 0.475 . . . . 64.42 111.809 -178.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -136.74 107.96 6.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.654 -0.703 . . . . 72.21 110.163 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.736 HD21 HG13 ' A' ' 223' ' ' ILE . 2.3 tt -69.99 130.0 41.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.426 -0.352 . . . . 64.44 110.809 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 24.7 t -108.8 -30.14 2.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.253 -0.43 . . . . 73.23 111.423 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . 0.431 ' N ' HD23 ' A' ' 220' ' ' LEU . 7.8 t70 -170.0 160.16 8.1 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.901 0.381 . . . . 64.44 111.236 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.736 HG13 HD21 ' A' ' 220' ' ' LEU . 31.9 mt -142.83 111.82 2.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.03 -0.532 . . . . 54.35 111.014 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . 0.434 ' C ' HG12 ' A' ' 130' ' ' VAL . 1.1 m-20 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.243 -0.435 . . . . 74.43 110.902 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 mpp? . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.826 0.346 . . . . 64.4 111.207 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -175.13 116.31 0.16 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 71.41 111.092 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.611 ' O ' ' HB2' ' A' ' 4' ' ' ALA . . . -67.35 -177.28 0.68 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.227 -0.442 . . . . 72.32 111.118 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.611 ' HB2' ' O ' ' A' ' 3' ' ' ALA . . . 163.23 86.47 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.11 -0.496 . . . . 63.33 111.065 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.939 HG11 HG21 ' A' ' 136' ' ' THR . 40.0 t -87.61 110.76 37.07 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.521 -0.309 . . . . 41.45 110.846 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.451 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 88.9 Cg_endo -80.9 140.2 12.6 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.622 2.215 . . . . 72.05 112.623 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -83.87 154.62 23.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 62.42 110.863 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.57 89.92 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.114 -0.493 . . . . 65.42 111.47 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.83 -32.38 67.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 62.4 111.18 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.557 ' NE1' HD11 ' A' ' 20' ' ' LEU . 1.9 m-90 -118.63 173.86 6.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 74.33 110.927 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.465 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -116.66 153.08 32.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.962 -0.563 . . . . 70.25 110.424 179.542 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.533 HG11 ' HG3' ' A' ' 154' ' ' LYS . 24.1 t -55.96 -33.74 36.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.926 0.394 . . . . 55.11 111.009 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -71.13 -27.67 63.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.986 -0.552 . . . . 72.03 111.286 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.465 ' HB2' HG23 ' A' ' 11' ' ' THR . 0.0 OUTLIER -82.34 -56.38 3.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.811 0.339 . . . . 73.35 111.208 -179.82 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.763 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.2 mt -49.51 -65.07 0.63 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.245 -0.434 . . . . 61.12 111.228 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.408 ' HD2' HG12 ' A' ' 12' ' ' VAL . 16.0 mtt180 -53.55 -25.1 15.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 71.21 111.258 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.69 172.72 0.16 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.941 0.401 . . . . 72.31 111.239 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -110.3 16.84 21.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.92 -0.582 . . . . 53.4 111.254 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -111.34 -23.58 10.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.568 -0.287 . . . . 71.52 111.224 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.849 HD22 HD11 ' A' ' 25' ' ' ILE . 10.1 tt -87.12 116.52 66.35 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.458 -0.337 . . . . 62.25 110.921 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.45 123.27 13.22 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.384 2.056 . . . . 55.45 112.237 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.4 -24.11 66.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 72.23 111.308 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -53.16 -35.24 59.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.421 -0.354 . . . . 64.23 111.295 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -77.56 -49.74 14.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.287 -0.415 . . . . 72.11 110.921 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.849 HD11 HD22 ' A' ' 20' ' ' LEU . 25.1 mt -47.03 -36.91 3.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.898 -0.592 . . . . 72.23 111.246 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.736 HG12 HD21 ' A' ' 59' ' ' LEU . 10.7 mt -72.04 -49.26 45.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 42.31 110.848 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.539 ' HG3' HD11 ' A' ' 47' ' ' ILE . 0.7 OUTLIER -57.23 -23.43 48.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.69 -0.687 . . . . 71.42 111.098 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -74.23 -49.78 21.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.002 0.43 . . . . 73.5 111.061 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.789 HD21 ' HA ' ' A' ' 63' ' ' TYR . 3.5 mt -66.3 -28.55 68.77 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.872 -0.603 . . . . 44.44 111.291 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -76.21 -28.01 57.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.52 -0.309 . . . . 64.44 111.016 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.423 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 10.7 pt-20 -89.91 -38.48 13.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.832 0.348 . . . . 71.32 110.817 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.451 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 42.4 m170 -100.49 16.61 24.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 64.32 110.982 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.6 152.11 21.49 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.831 -0.7 . . . . 63.44 112.512 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.8 p -92.73 156.52 16.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.642 0.258 . . . . 75.42 110.604 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.438 ' HA ' HD21 ' A' ' 44' ' ' LEU . 1.4 m-20 -48.0 -54.68 12.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.765 0.316 . . . . 65.23 111.31 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 82.5 p -51.06 -46.69 61.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.023 0.439 . . . . 75.33 110.695 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.449 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 22.2 t80 -57.11 -48.18 79.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.745 -0.661 . . . . 64.14 110.775 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.751 HD22 ' HB3' ' A' ' 43' ' ' LEU . 11.8 mt -63.24 -46.87 84.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 71.53 110.909 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.913 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -49.46 -31.05 9.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 41.25 111.243 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -72.92 -32.46 65.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 71.21 111.073 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.707 ' ND1' ' HB2' ' A' ' 62' ' ' ALA . 6.7 m-70 -110.14 12.14 23.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.377 -0.374 . . . . 75.44 111.548 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 59.96 32.13 20.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.747 0.308 . . . . 70.32 111.01 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.751 ' HB3' HD22 ' A' ' 38' ' ' LEU . 15.5 mt -85.93 -22.05 27.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.257 -0.429 . . . . 74.12 111.042 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.913 HD11 ' HB2' ' A' ' 39' ' ' ALA . 92.4 mt -48.01 170.47 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.931 0.396 . . . . 63.11 111.234 179.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.88 -160.13 32.15 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.846 -0.692 . . . . 63.23 112.796 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.877 ' O ' HG23 ' A' ' 50' ' ' VAL . 36.7 m-80 -102.62 147.11 27.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.963 0.411 . . . . 72.44 111.065 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.587 HG23 HD12 ' A' ' 26' ' ' ILE . 3.3 mp -45.36 -43.59 3.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.889 -0.596 . . . . 74.34 111.513 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -43.15 72.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.981 -0.554 . . . . 73.35 111.047 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -85.68 -28.95 24.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.956 -0.565 . . . . 73.24 111.22 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.877 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.8 t -73.01 -27.57 24.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.299 -0.41 . . . . 74.14 111.454 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.51 -25.86 66.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.427 -0.351 . . . . 54.35 111.359 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.25 -27.38 15.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.287 -0.415 . . . . 75.31 111.244 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.4 m -84.33 -21.43 30.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.353 -0.385 . . . . 74.33 111.414 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -120.58 131.48 54.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.795 0.331 . . . . 72.13 111.349 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -77.81 -178.12 5.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 52.2 110.474 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.465 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -61.28 -58.42 8.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.816 0.341 . . . . 72.53 110.536 179.962 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.24 -26.72 67.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.143 -0.481 . . . . 72.45 110.664 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.67 -37.95 83.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.108 0.48 . . . . 72.4 110.249 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.736 HD21 HG12 ' A' ' 26' ' ' ILE . 14.2 mt -76.25 -31.71 58.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.614 -0.721 . . . . 73.11 110.955 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.763 HG22 ' HB3' ' A' ' 15' ' ' LEU . 15.1 t -78.46 -42.81 26.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.051 0.453 . . . . 71.34 110.705 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 32.8 m -59.27 -35.6 74.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.842 -0.617 . . . . 72.51 110.493 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.707 ' HB2' ' ND1' ' A' ' 41' ' ' HIS . . . -81.76 -20.85 38.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.024 -0.535 . . . . 74.24 110.957 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.789 ' HA ' HD21 ' A' ' 29' ' ' LEU . 8.2 t80 -83.67 -22.99 31.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.194 -0.457 . . . . 71.52 110.86 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.508 ' ND2' HG12 ' A' ' 60' ' ' VAL . 37.1 m-80 -85.6 -53.91 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 74.24 111.369 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.449 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.2 p-80 -60.99 -28.29 68.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.111 -0.495 . . . . 73.43 111.136 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.67 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.8 tt -50.27 -40.51 48.35 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.977 0.417 . . . . 62.22 110.973 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.418 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.4 m-85 -78.95 -37.48 39.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.892 -0.594 . . . . 63.31 110.578 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.04 -40.47 91.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.893 -0.594 . . . . 74.31 110.999 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.01 -9.53 48.29 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.076 -0.511 . . . . 71.54 111.278 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.59 33.73 19.79 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.741 0.305 . . . . 74.23 111.244 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -90.56 46.29 1.32 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.387 -0.37 . . . . 74.15 111.078 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.428 ' CE2' ' HD2' ' A' ' 6' ' ' PRO . 93.3 m-85 -67.32 169.77 8.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.293 -0.412 . . . . 75.25 110.742 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.1 ttmm -66.59 125.94 27.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.329 -0.396 . . . . 61.43 110.861 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -96.99 27.97 15.92 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.703 -0.76 . . . . 73.33 112.527 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.493 HG22 ' H ' ' A' ' 76' ' ' GLU . 0.2 OUTLIER 60.14 178.93 0.09 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.832 0.349 . . . . 70.21 110.859 179.982 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.493 ' H ' HG22 ' A' ' 75' ' ' THR . 5.2 mm-40 -157.46 -45.16 0.07 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.193 -0.458 . . . . 64.31 110.941 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.56 ' O ' HG23 ' A' ' 78' ' ' ILE . 63.9 p -126.86 122.1 33.73 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.061 -0.518 . . . . 53.33 110.914 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.56 HG23 ' O ' ' A' ' 77' ' ' SER . 8.1 pt -159.46 -42.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.474 . . . . 72.33 111.259 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 14.6 m -154.36 105.81 2.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.114 -0.493 . . . . 42.14 110.903 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -104.57 -178.54 3.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 74.43 110.896 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 27.7 t 63.93 116.56 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 72.15 111.056 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 79.6 p -160.9 -48.66 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 54.04 110.904 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -164.95 98.61 0.75 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 72.43 110.871 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.81 162.81 23.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 64.41 110.941 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -126.42 96.66 3.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 70.0 111.11 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.18 141.73 36.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 71.32 110.831 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -103.01 -32.89 9.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 62.33 110.922 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.449 ' HB ' HD23 ' A' ' 90' ' ' LEU . 15.2 m -89.86 153.08 3.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.445 . . . . 72.34 111.15 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -104.73 64.52 0.74 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 64.55 110.845 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.449 HD23 ' HB ' ' A' ' 88' ' ' VAL . 4.4 mm? -111.28 -33.22 6.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.459 . . . . 53.45 110.918 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -106.35 -31.73 8.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.473 . . . . 44.21 110.927 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -78.82 126.28 30.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.455 . . . . 61.43 110.865 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -163.72 151.73 13.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 75.11 110.929 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.0 mttt 60.14 78.61 0.32 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 73.12 110.873 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.35 -27.38 30.93 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.574 2.183 . . . . 75.13 112.342 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 7.0 tptm -70.65 -35.38 72.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 73.51 110.903 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 59.3 107.95 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.171 -0.468 . . . . 73.3 110.954 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 12.1 p -129.95 110.17 11.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.444 . . . . 73.23 110.905 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.2 -31.38 7.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 64.44 110.897 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.8 m -96.64 -169.68 1.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 61.11 110.887 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -172.19 -41.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 74.32 110.869 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -88.82 -178.52 5.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.091 -0.504 . . . . 53.35 110.912 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.9 m -161.76 154.42 20.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 64.14 110.899 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.5 mp -97.49 169.61 9.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 72.4 110.926 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -151.97 -169.58 3.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 53.23 110.858 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 63.78 -80.21 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 61.14 111.021 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 135.57 91.65 0.35 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.803 -0.713 . . . . 25.44 112.469 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.89 166.54 27.42 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.593 2.195 . . . . 63.12 112.317 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.433 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 32.9 Cg_exo -57.85 -158.35 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.627 2.218 . . . . 73.02 112.31 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.26 39.13 1.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.271 -0.422 . . . . 75.52 110.893 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.433 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 6.2 p90 -173.03 153.82 2.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 53.53 110.897 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 19.7 m -115.85 130.55 56.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.276 -0.42 . . . . 72.22 110.327 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.527 ' HE2' HG22 ' A' ' 115' ' ' VAL . 4.6 tttt -127.65 144.85 51.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.926 0.393 . . . . 74.52 111.227 -179.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.3 m -142.51 119.81 11.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 74.52 110.681 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.527 HG22 ' HE2' ' A' ' 113' ' ' LYS . 27.5 t -80.29 106.36 11.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.431 . . . . 73.22 111.211 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.532 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -79.33 -49.36 12.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.214 -0.448 . . . . 71.1 110.795 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -121.8 107.99 12.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 75.34 110.957 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.6 mttm -63.03 143.63 57.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.223 -0.444 . . . . 71.44 110.895 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -106.15 -165.05 23.0 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.687 -0.768 . . . . 65.13 112.409 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -36.56 -42.57 0.36 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.846 0.355 . . . . 64.22 111.826 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.6 tttt 74.55 42.22 0.31 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.135 -0.484 . . . . 74.54 110.582 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 69.1 m -164.26 -43.37 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.946 -0.57 . . . . 62.12 110.722 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -86.83 101.12 13.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 72.11 110.911 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -120.24 147.67 45.47 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 72.23 110.834 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.456 ' CB ' HG21 ' A' ' 166' ' ' VAL . 50.7 Cg_exo -54.37 127.63 26.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.56 2.174 . . . . 54.2 112.547 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.56 ' O ' HG23 ' A' ' 166' ' ' VAL . 1.1 mttp -99.18 152.19 20.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 74.31 110.706 179.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.48 114.05 1.52 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.335 -0.393 . . . . 74.53 111.114 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 93.44 -2.37 70.64 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.762 -0.732 . . . . 62.45 112.982 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -92.15 137.77 32.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.919 0.39 . . . . 71.0 111.071 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.518 HG22 ' N ' ' A' ' 131' ' ' VAL . 7.5 p -70.05 161.27 4.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.078 -0.51 . . . . 75.52 110.971 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.751 HG12 HG23 ' A' ' 223' ' ' ILE . 5.5 m -153.58 144.71 14.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 72.22 111.07 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.475 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.96 117.75 22.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.543 -0.299 . . . . 65.13 110.805 179.753 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.5 ' HA ' HG23 ' A' ' 221' ' ' VAL . 30.2 p -150.12 168.09 24.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.0 0.429 . . . . 53.14 111.182 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.718 ' HB3' HD11 ' A' ' 149' ' ' ILE . 51.3 m95 -101.89 157.76 16.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.813 -0.63 . . . . 73.11 109.747 179.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.471 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 49.8 p90 -162.45 139.06 7.78 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.296 -0.561 . . . . 64.15 112.22 -179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.939 HG21 HG11 ' A' ' 5' ' ' VAL . 81.1 m -129.26 112.48 13.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.466 -0.788 . . . . 71.24 110.457 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.648 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.73 146.15 18.11 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.598 -0.81 . . . . 62.23 113.184 -179.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.635 HG23 HG12 ' A' ' 144' ' ' VAL . 0.0 OUTLIER -152.21 147.1 26.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.789 0.328 . . . . 74.21 110.833 179.815 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.686 HD21 HD12 ' A' ' 208' ' ' ILE . 41.4 mt -80.5 -178.37 6.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 74.14 110.694 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -56.92 -43.82 81.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.901 0.382 . . . . 71.13 111.018 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.7 -6.61 47.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.996 -0.547 . . . . 65.4 111.462 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . 0.438 ' HA2' ' HB2' ' A' ' 3' ' ' ALA . . . 92.43 20.45 35.04 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.666 -0.778 . . . . 63.54 112.729 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -89.48 113.8 25.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 73.11 110.675 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.635 HG12 HG23 ' A' ' 138' ' ' THR . 5.7 m -63.68 138.5 22.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 64.04 111.134 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.675 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 40.3 p90 -117.81 -40.96 2.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 60.45 110.929 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -154.53 115.2 3.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.067 -0.515 . . . . 75.03 110.715 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.406 ' CB ' ' HA ' ' A' ' 136' ' ' THR . 6.9 t -142.76 126.97 17.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.302 -0.408 . . . . 64.4 111.237 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.502 ' O ' HD13 ' A' ' 149' ' ' ILE . 22.3 t30 -89.01 55.44 3.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.196 0.522 . . . . 73.32 109.915 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.718 HD11 ' HB3' ' A' ' 134' ' ' TRP . 45.3 mm -131.62 96.45 2.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.74 -0.664 . . . . 74.41 111.05 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -90.6 -75.32 0.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 74.43 110.912 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 4.6 m -146.5 165.98 27.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 61.03 110.946 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.4 m -89.26 171.01 10.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 74.02 110.89 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.02 -30.59 34.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 71.12 111.086 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.533 ' HG3' HG11 ' A' ' 12' ' ' VAL . 3.8 tmtt? -59.66 -31.82 69.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 73.1 110.943 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -86.92 -34.72 19.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 74.44 110.917 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -177.66 139.47 0.24 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 63.42 110.918 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.29 74.16 2.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 74.21 110.864 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -146.77 61.23 1.2 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 73.41 110.86 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.437 ' HB1' ' HH2' ' A' ' 134' ' ' TRP . . . -150.68 139.16 20.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.15 -0.477 . . . . 73.24 111.094 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.4 tttt -146.34 116.06 4.65 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.446 . . . . 43.34 110.855 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.42 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 53.8 Cg_exo -52.41 155.05 10.31 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.376 2.05 . . . . 65.54 112.258 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.65 117.83 16.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 75.12 110.517 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.637 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -100.6 123.31 44.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.939 0.399 . . . . 72.13 111.474 -179.733 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.704 ' O ' HG22 ' A' ' 131' ' ' VAL . 11.7 p90 -153.38 145.41 23.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.965 -0.561 . . . . 73.31 110.528 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.601 ' O ' HG22 ' A' ' 168' ' ' VAL . 9.6 mtpt -81.17 138.9 35.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.136 0.493 . . . . 75.33 111.248 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 126' ' ' LYS . 6.2 m -87.3 149.37 4.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.566 -0.743 . . . . 63.5 111.128 -179.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.63 22.82 78.04 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.836 -0.697 . . . . 74.34 112.6 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 165' ' ' LYS . 28.0 m -131.24 40.52 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.35 . . . . 65.42 111.111 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.52 38.06 6.94 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 121.071 -0.585 . . . . 53.03 113.135 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.51 -47.0 11.81 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.94 0.4 . . . . 64.22 110.983 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . 0.467 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.3 OUTLIER -119.0 -179.48 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.001 -0.545 . . . . 64.21 111.026 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.537 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.8 158.89 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.316 -0.402 . . . . 73.33 111.281 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 17.0 ttm105 -67.73 -27.88 67.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.271 -0.422 . . . . 75.13 110.965 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.1 -38.06 48.17 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.694 -0.765 . . . . 72.11 111.881 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.775 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.2 t90 -78.6 -33.0 47.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.993 0.425 . . . . 74.11 110.883 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . 0.402 ' O ' HD13 ' A' ' 180' ' ' LEU . 35.9 t70 -64.91 -32.17 73.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.877 -0.601 . . . . 72.24 110.538 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -80.84 -28.93 35.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.055 -0.52 . . . . 71.31 110.665 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.533 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -80.7 -56.36 4.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 65.33 111.059 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.691 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 6.2 mt -56.01 -31.3 62.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.924 -0.58 . . . . 61.44 110.797 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.402 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.4 tp -53.41 -28.88 32.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.085 -0.507 . . . . 72.34 111.344 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 27.1 p -105.65 4.59 30.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.372 -0.376 . . . . 74.52 111.793 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.474 ' O ' HD13 ' A' ' 220' ' ' LEU . 5.3 mtp -74.33 101.98 4.23 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.903 0.383 . . . . 75.15 110.89 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.9 161.39 18.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.927 -0.579 . . . . 72.3 111.409 -179.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . 0.642 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -60.86 117.65 5.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.56 -0.745 . . . . 74.13 111.2 -179.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 81.65 10.42 84.33 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.869 -0.682 . . . . 64.05 113.137 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -86.18 151.07 23.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 71.21 111.27 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -127.42 138.16 52.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.998 -0.546 . . . . 64.4 109.976 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.05 172.5 13.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.226 0.536 . . . . 75.34 112.147 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.82 101.09 4.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.391 -0.822 . . . . 75.13 109.715 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.533 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.6 pt? -122.18 147.94 45.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.121 0.486 . . . . 70.1 111.881 -179.04 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.619 ' HB3' HG23 ' A' ' 215' ' ' THR . 10.5 pt-20 -120.47 120.53 36.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.705 -0.68 . . . . 64.12 110.564 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.471 ' CD1' ' CZ ' ' A' ' 216' ' ' PHE . 5.0 mp -100.49 139.46 21.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 64.55 111.347 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -77.0 164.88 56.41 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.933 -0.576 . . . . 72.21 110.756 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . 0.41 ' HG3' ' N ' ' A' ' 212' ' ' ALA . 53.1 Cg_exo -54.93 -42.0 73.25 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.588 2.192 . . . . 72.34 112.303 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -52.29 -30.41 27.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 72.03 111.379 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.461 ' O ' HG21 ' A' ' 192' ' ' ILE . 23.7 m0 -115.6 36.95 3.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.404 -0.362 . . . . 74.32 111.227 -179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -154.93 -85.2 0.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.447 -0.342 . . . . 71.41 111.25 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . 0.519 ' HD2' HG21 ' A' ' 208' ' ' ILE . 28.7 m-85 -107.55 -33.47 7.32 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.043 0.449 . . . . 75.42 110.624 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 109.29 173.1 20.95 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.912 -0.661 . . . . 31.11 112.821 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -32.57 70.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.788 0.328 . . . . 62.04 110.831 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -56.78 -54.71 43.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.203 -0.453 . . . . 64.33 110.643 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 117.87 -162.4 13.08 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.833 -0.699 . . . . 72.02 112.673 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.438 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 1.6 tm0? -153.02 84.99 4.37 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.85 0.357 . . . . 70.23 110.355 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -48.67 -49.67 14.26 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.803 2.335 . . . . 71.34 113.048 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -50.93 -42.32 59.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.914 0.388 . . . . 72.14 111.088 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.675 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -95.65 26.75 3.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.033 -0.53 . . . . 73.35 111.384 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 4.0 mptt 47.84 30.68 1.99 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.83 0.348 . . . . 65.44 111.075 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.686 HD12 HD21 ' A' ' 139' ' ' LEU . 22.7 mm -92.81 111.71 52.48 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 74.25 111.28 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . 0.567 ' HG2' ' HB2' ' A' ' 212' ' ' ALA . 74.4 Cg_endo -74.99 160.88 39.67 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.414 2.076 . . . . 75.31 112.17 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -51.33 115.3 1.98 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.473 2.115 . . . . 71.3 112.298 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 66.24 73.53 0.37 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.232 -0.44 . . . . 62.34 110.912 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . 0.567 ' HB2' ' HG2' ' A' ' 209' ' ' PRO . . . -126.22 124.68 40.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.248 -0.433 . . . . 74.03 111.329 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 3.8 tptm -65.67 151.82 45.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.106 -0.497 . . . . 72.51 110.578 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 6.1 mt -130.48 109.42 10.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.814 0.34 . . . . 70.33 111.405 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.619 HG23 ' HB3' ' A' ' 191' ' ' GLU . 3.8 m -106.38 139.72 40.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 62.53 110.573 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.648 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 6.4 p90 -156.44 178.75 9.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.107 0.48 . . . . 62.31 111.514 -179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -133.01 137.13 46.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.613 -0.721 . . . . 74.34 110.279 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.775 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.3 t -124.15 151.26 29.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.107 0.48 . . . . 54.35 112.086 -178.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -136.88 110.98 8.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.598 -0.728 . . . . 61.25 110.132 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.792 HD21 HG13 ' A' ' 223' ' ' ILE . 2.9 tt -70.83 128.04 34.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.84 0.352 . . . . 70.11 110.988 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.5 HG23 ' HA ' ' A' ' 133' ' ' CYS . 15.5 t -104.97 -30.43 2.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.125 -0.488 . . . . 60.12 111.571 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -171.21 162.46 6.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.867 0.365 . . . . 74.31 111.239 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.792 HG13 HD21 ' A' ' 220' ' ' LEU . 30.2 mt -143.49 112.23 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.006 -0.543 . . . . 64.15 110.964 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . 0.491 ' C ' HG12 ' A' ' 130' ' ' VAL . 3.3 m-20 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 72.44 110.89 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 mpp? . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.873 0.368 . . . . 74.53 111.189 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -147.87 165.19 31.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 51.01 111.118 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.451 ' O ' ' HB3' ' A' ' 4' ' ' ALA . . . 59.64 174.48 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 74.12 111.099 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 3' ' ' ALA . . . 69.78 158.55 0.17 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.188 -0.46 . . . . 74.25 111.058 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 1.091 HG11 HG21 ' A' ' 136' ' ' THR . 38.5 t -95.17 114.19 63.19 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 73.32 111.217 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -77.12 132.89 13.04 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.731 2.287 . . . . 72.25 112.401 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.8 ' OE1' HD11 ' A' ' 149' ' ' ILE . 7.2 mm100 -79.79 146.54 32.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 71.12 110.943 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.523 ' HE ' HG23 ' A' ' 149' ' ' ILE . 0.0 OUTLIER -50.81 115.63 1.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.036 -0.529 . . . . 74.32 111.192 -179.829 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.43 ' HB2' ' NZ ' ' A' ' 187' ' ' LYS . . . -89.25 -39.39 13.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.226 -0.443 . . . . 70.11 110.871 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.517 ' NE1' HD21 ' A' ' 20' ' ' LEU . 1.5 m-90 -104.36 160.05 15.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.023 -0.535 . . . . 72.14 110.703 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 m -99.26 151.87 20.55 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.048 -0.524 . . . . 60.1 110.533 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.635 ' HA ' HD12 ' A' ' 15' ' ' LEU . 44.0 t -56.67 -37.0 50.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.922 0.392 . . . . 75.52 110.437 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.403 ' O ' ' HB2' ' A' ' 17' ' ' SER . 2.1 tt0 -66.02 -27.4 68.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.962 -0.563 . . . . 72.54 110.86 179.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.544 ' OE1' HD23 ' A' ' 20' ' ' LEU . 6.3 mt-30 -80.08 -54.53 5.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.985 -0.552 . . . . 73.21 111.564 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.756 ' HB3' HG22 ' A' ' 60' ' ' VAL . 2.0 mt -50.07 -66.69 0.35 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.727 0.298 . . . . 71.33 111.797 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 12' ' ' VAL . 1.5 ptm180 -60.59 -26.21 66.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.383 -0.371 . . . . 71.31 111.371 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.433 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.4 OUTLIER -50.85 177.28 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.928 0.394 . . . . 55.51 111.273 -179.92 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.19 16.68 21.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.946 -0.57 . . . . 74.31 111.107 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -117.6 -19.32 9.44 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.418 -0.356 . . . . 71.13 111.273 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 1.122 HD12 HD11 ' A' ' 25' ' ' ILE . 1.6 tm? -84.58 121.74 74.87 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.508 -0.315 . . . . 64.43 110.852 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.656 ' HD2' HD22 ' A' ' 20' ' ' LEU . 43.7 Cg_endo -67.84 123.25 10.49 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.428 2.086 . . . . 62.34 112.369 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.624 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -66.15 -24.23 66.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.11 -0.495 . . . . 61.33 111.403 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -53.43 -45.56 69.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.411 -0.358 . . . . 75.34 111.494 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.98 -23.29 48.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.162 -0.472 . . . . 71.43 111.475 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.122 HD11 HD12 ' A' ' 20' ' ' LEU . 57.1 mt -70.74 -43.22 77.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.925 0.393 . . . . 74.23 111.127 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.744 ' HB ' HG23 ' A' ' 47' ' ' ILE . 4.0 mt -68.72 -40.19 81.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.017 -0.538 . . . . 73.43 111.102 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -67.18 -25.83 66.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.001 -0.545 . . . . 75.04 111.062 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -70.04 -43.76 70.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.033 0.444 . . . . 54.05 110.875 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.562 HD21 ' HA ' ' A' ' 63' ' ' TYR . 2.8 mt -72.79 -21.35 61.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.888 -0.597 . . . . 74.42 111.04 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -82.68 -24.13 33.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.412 -0.358 . . . . 75.0 111.029 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.82 1.65 31.8 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.374 -0.375 . . . . 72.42 111.417 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -131.86 -10.66 3.45 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.687 0.255 . . . . 71.51 111.687 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.81 167.66 12.48 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.738 -0.744 . . . . 51.31 112.41 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.7 p -93.86 149.87 20.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.58 0.229 . . . . 74.12 110.489 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.624 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -48.07 -56.98 6.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.807 0.337 . . . . 74.55 110.994 -179.75 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.2 m -48.41 -50.7 29.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 72.15 110.832 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.512 ' CE2' HD12 ' A' ' 66' ' ' LEU . 17.6 t80 -54.06 -48.03 71.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.853 -0.612 . . . . 70.43 110.492 179.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.411 HD22 ' HB3' ' A' ' 43' ' ' LEU . 13.2 mt -66.71 -41.79 87.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.094 -0.503 . . . . 72.31 110.784 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.808 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.57 -47.71 28.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.989 0.423 . . . . 63.43 111.206 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -57.51 -27.22 62.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.812 -0.631 . . . . 74.44 110.982 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 65.5 m-70 -112.53 9.81 19.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.314 -0.403 . . . . 62.01 111.231 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.4 37.77 28.27 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.94 0.4 . . . . 64.32 110.664 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.696 HD21 HD23 ' A' ' 59' ' ' LEU . 17.7 mt -95.94 -19.74 19.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.986 -0.552 . . . . 61.44 111.851 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.808 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -82.11 155.76 24.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.078 0.466 . . . . 71.33 111.101 -179.853 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.37 -122.63 5.5 Favored Glycine 0 N--CA 1.452 -0.292 0 CA-C-N 115.648 -0.705 . . . . 74.43 112.429 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.667 ' O ' HG23 ' A' ' 50' ' ' VAL . 6.0 m-80 -116.34 115.43 25.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.736 0.303 . . . . 63.45 111.059 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.744 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.5 mp -44.85 -53.5 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.178 -0.465 . . . . 75.1 111.447 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.56 -37.2 7.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.868 -0.605 . . . . 75.44 111.05 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -85.69 -26.58 25.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 72.11 111.255 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.667 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.4 t -82.79 -26.56 8.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.432 -0.349 . . . . 71.52 111.597 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.95 -17.85 64.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.427 -0.351 . . . . 61.34 111.454 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 ptpt -95.06 -31.96 13.34 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.445 -0.343 . . . . 71.2 111.09 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -87.88 -33.68 18.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.24 -0.436 . . . . 75.21 111.131 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -91.21 128.58 37.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.29 -0.414 . . . . 71.21 111.239 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -84.88 178.63 7.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 53.1 110.678 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.576 ' O ' HG23 ' A' ' 60' ' ' VAL . 2.4 tptt -60.03 -58.1 10.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.91 0.386 . . . . 75.34 110.653 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -27.4 69.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.072 -0.513 . . . . 63.54 110.522 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.02 -41.45 96.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 32.13 110.431 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.696 HD23 HD21 ' A' ' 43' ' ' LEU . 20.3 mt -75.55 -30.15 59.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.7 -0.682 . . . . 74.52 110.99 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.756 HG22 ' HB3' ' A' ' 15' ' ' LEU . 18.8 t -78.26 -42.91 27.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.305 -0.407 . . . . 73.5 110.93 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.7 m -61.98 -33.92 75.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.948 -0.569 . . . . 72.43 110.792 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.423 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -80.86 -23.49 39.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 62.14 111.107 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.562 ' HA ' HD21 ' A' ' 29' ' ' LEU . 71.8 t80 -83.66 -22.86 32.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 74.11 110.953 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.406 ' ND2' HG12 ' A' ' 60' ' ' VAL . 20.4 m-80 -82.88 -54.65 4.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.048 -0.524 . . . . 63.54 111.373 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.487 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 3.4 p-80 -63.0 -26.0 68.65 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.072 -0.513 . . . . 74.32 111.433 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.668 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.6 tt -54.57 -39.04 67.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.847 0.356 . . . . 73.1 111.026 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.422 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 5.2 m-85 -78.98 -38.16 37.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.106 -0.497 . . . . 70.32 110.574 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.63 -40.53 84.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.97 -0.559 . . . . 70.03 110.78 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 75.1 p -90.34 -4.66 56.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.95 -0.568 . . . . 72.13 111.467 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 48.36 37.73 9.19 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.703 0.287 . . . . 55.5 111.287 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.433 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 41.2 mtt180 -94.25 44.03 1.11 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.38 -0.373 . . . . 75.25 111.115 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.419 ' HA ' HD21 ' A' ' 66' ' ' LEU . 81.5 m-85 -65.69 -178.29 0.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 62.42 110.783 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -72.31 153.01 41.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.289 -0.414 . . . . 63.13 110.948 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -130.56 164.97 22.89 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.722 -0.751 . . . . 63.22 112.47 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 79.0 p -60.25 152.37 24.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.75 0.309 . . . . 75.34 110.928 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -144.39 -46.78 0.25 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 73.3 110.994 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.4 m -123.58 125.73 45.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.996 -0.547 . . . . 62.24 110.899 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 3.9 mp -112.15 -33.28 2.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.182 -0.463 . . . . 74.21 111.142 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.47 160.36 15.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 64.4 110.912 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.24 -33.59 6.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 63.43 110.892 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.0 m -118.07 146.71 22.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 64.34 111.129 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.8 m -176.65 138.02 0.28 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 61.43 110.928 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 60.78 158.66 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 75.13 110.946 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.688 ' O ' HG13 ' A' ' 85' ' ' VAL . 2.2 tt0 61.19 154.8 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 63.43 110.962 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.688 HG13 ' O ' ' A' ' 84' ' ' GLN . 0.3 OUTLIER -165.9 102.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.896 -0.593 . . . . 64.44 111.095 -179.717 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.8 ttpp -143.96 138.45 28.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.209 -0.45 . . . . 75.04 110.9 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -176.63 97.38 0.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 40.24 110.939 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.56 HG12 ' H ' ' A' ' 91' ' ' ASN . 20.5 t 63.82 141.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.464 . . . . 74.11 111.065 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.35 -34.03 10.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.479 . . . . 61.43 110.917 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.538 ' H ' HD23 ' A' ' 90' ' ' LEU . 0.5 OUTLIER -72.08 -31.12 65.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 75.41 110.921 -179.973 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.56 ' H ' HG12 ' A' ' 88' ' ' VAL . 2.5 m120 -133.86 175.97 8.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 72.32 110.878 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -176.38 131.42 0.22 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.47 . . . . 63.13 110.889 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -132.52 161.52 33.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 73.3 110.869 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.9 mttt -106.25 86.53 2.11 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 63.2 110.883 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.02 143.21 48.89 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.572 2.181 . . . . 54.35 112.286 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.58 140.04 40.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 74.5 110.88 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -132.25 139.99 48.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 74.43 110.893 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.6 t -104.47 142.74 34.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 74.21 110.971 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -108.23 -31.5 7.87 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 65.31 110.905 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.1 m -96.9 177.21 5.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 74.05 110.897 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -176.59 105.1 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 74.12 110.875 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -150.12 -177.51 5.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 75.01 110.921 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 6.2 m 63.59 126.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.165 -0.471 . . . . 70.14 110.922 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.74 -168.87 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 73.04 110.873 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -110.17 -31.47 7.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.196 -0.456 . . . . 61.14 110.894 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -78.67 -33.23 47.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 74.01 110.919 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 96.8 67.68 0.95 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.765 -0.731 . . . . 65.1 112.49 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -68.96 171.27 13.87 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.615 2.21 . . . . 62.41 112.284 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.44 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 31.4 Cg_endo -63.87 -166.73 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.581 2.187 . . . . 60.34 112.258 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.441 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -97.84 30.07 3.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 74.54 110.987 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.44 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 45.0 p90 -154.89 -176.81 6.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 74.43 110.81 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -161.46 104.93 1.26 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.332 -0.394 . . . . 61.14 110.733 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.405 ' HB2' ' CD1' ' A' ' 190' ' ' LEU . 2.7 ptmm? -98.46 151.4 20.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.983 0.42 . . . . 72.23 111.241 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 2.1 m -148.61 111.67 4.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.887 -0.597 . . . . 74.51 110.391 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 26.1 t -73.58 106.29 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.305 -0.407 . . . . 75.52 111.324 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.822 HD12 ' HA ' ' A' ' 188' ' ' ALA . 3.5 mp -75.54 -32.02 60.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 63.24 110.508 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.7 tttt -140.35 110.47 6.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.036 -0.529 . . . . 62.24 110.668 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.0 tptt -57.99 134.76 56.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.262 -0.426 . . . . 71.44 110.968 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.513 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -108.63 -155.08 17.23 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.713 -0.756 . . . . 75.32 112.425 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -36.07 -53.44 0.78 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.008 0.432 . . . . 63.42 111.445 -179.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 70.87 33.71 2.12 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.816 -0.629 . . . . 72.42 110.248 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 62.7 m -154.51 -45.13 0.09 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.753 -0.658 . . . . 54.2 110.683 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -89.08 92.57 9.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.119 -0.492 . . . . 63.5 110.84 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -102.83 154.91 37.18 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.117 -0.492 . . . . 61.23 110.847 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.709 ' HB2' HG21 ' A' ' 166' ' ' VAL . 53.9 Cg_endo -69.73 125.5 12.23 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.522 2.148 . . . . 62.2 112.332 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.432 ' O ' HG23 ' A' ' 166' ' ' VAL . 0.1 OUTLIER -96.44 152.42 18.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 75.12 110.925 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.48 118.98 6.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 74.14 110.859 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 97.36 -16.04 61.28 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.699 -0.763 . . . . 74.22 112.606 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -84.09 140.41 31.83 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.876 0.369 . . . . 74.0 110.969 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.557 HG12 ' C ' ' A' ' 224' ' ' ASP . 8.4 p -71.04 163.45 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 75.25 111.041 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.883 HG22 ' O ' ' A' ' 164' ' ' PHE . 13.0 m -154.91 146.26 13.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.171 -0.468 . . . . 74.02 111.063 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.492 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -128.01 117.76 22.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.718 0.294 . . . . 75.1 110.838 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.465 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 26.1 p -155.27 170.18 22.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.927 0.394 . . . . 64.41 111.047 -179.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.771 ' HB3' HD13 ' A' ' 149' ' ' ILE . 38.2 m95 -106.08 164.6 11.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.949 -0.569 . . . . 74.22 110.308 179.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.504 ' OH ' HD13 ' A' ' 162' ' ' LEU . 12.3 p90 -162.08 137.07 7.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.926 0.394 . . . . 71.41 111.433 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 1.091 HG21 HG11 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -128.06 114.07 16.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.949 -0.568 . . . . 74.21 110.466 179.741 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.614 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.64 144.78 17.44 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.615 -0.802 . . . . 73.51 113.407 -179.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.885 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.95 136.78 18.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.702 0.286 . . . . 64.15 110.367 179.608 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 1.019 HD21 HD12 ' A' ' 208' ' ' ILE . 17.1 mt -68.45 -179.05 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.857 0.36 . . . . 73.2 111.035 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -57.04 -41.78 79.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.025 -0.534 . . . . 75.14 110.862 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.37 0.99 39.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 64.23 111.446 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 91.48 25.83 22.34 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.645 -0.788 . . . . 63.0 112.619 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.95 108.35 16.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.773 0.32 . . . . 75.3 110.835 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.418 HG13 ' O ' ' A' ' 144' ' ' VAL . 11.3 p -68.81 125.34 26.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 65.02 111.138 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.442 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 21.3 p90 -109.96 -22.2 11.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 73.1 111.002 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -162.06 137.9 7.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.401 -0.363 . . . . 75.15 110.836 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.905 HG23 HG23 ' A' ' 136' ' ' THR . 52.3 m -142.8 106.25 4.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 72.05 111.016 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.48 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 13.8 t30 -82.11 -14.81 55.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 71.34 111.226 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.8 HD11 ' OE1' ' A' ' 7' ' ' GLN . 25.4 mm -54.53 149.47 2.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.822 0.344 . . . . 73.33 111.096 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.538 ' HB3' ' HB1' ' A' ' 159' ' ' ALA . 0.0 OUTLIER -148.27 166.05 29.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 72.24 110.898 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 40.9 p -60.18 165.99 3.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.264 -0.426 . . . . 64.12 110.914 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.1 t -75.82 165.13 25.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 61.42 110.856 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.02 -30.56 34.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 73.14 111.104 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.49 -31.4 69.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 71.23 110.945 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 19.8 tptt -84.36 -31.54 24.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 75.23 110.913 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -175.06 122.39 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.449 . . . . 72.34 110.905 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -71.09 80.67 0.68 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 62.45 110.862 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -160.98 47.32 0.21 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 51.32 110.876 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.538 ' HB1' ' HB3' ' A' ' 150' ' ' GLN . . . -157.16 127.13 6.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.17 -0.468 . . . . 73.22 111.038 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -145.01 135.29 11.9 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 71.25 110.887 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.408 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 52.6 Cg_exo -54.68 163.49 3.86 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.445 2.097 . . . . 72.1 112.276 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.531 HD23 ' CD1' ' A' ' 164' ' ' PHE . 2.4 tt -84.54 119.41 25.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 72.42 110.595 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.626 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -95.17 121.79 37.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.897 0.379 . . . . 45.53 111.175 -179.93 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.883 ' O ' HG22 ' A' ' 131' ' ' VAL . 8.2 p90 -149.1 140.68 23.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.082 -0.508 . . . . 74.54 110.742 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.566 ' O ' HG22 ' A' ' 168' ' ' VAL . 56.1 mttt -80.68 137.41 36.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.076 0.465 . . . . 73.12 111.118 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.709 HG21 ' HB2' ' A' ' 125' ' ' PRO . 5.8 m -87.36 149.8 3.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.668 -0.696 . . . . 75.24 111.13 -179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.19 22.92 77.53 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.836 -0.697 . . . . 54.14 112.576 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.707 HG23 ' HG2' ' A' ' 170' ' ' LYS . 30.2 m -132.92 40.9 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.896 0.379 . . . . 52.52 111.032 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 49.12 38.85 26.0 Favored Glycine 0 CA--C 1.517 0.218 0 C-N-CA 120.936 -0.649 . . . . 71.14 112.896 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . 0.707 ' HG2' HG23 ' A' ' 168' ' ' VAL . 3.1 mmtt -83.02 -46.5 12.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.901 0.381 . . . . 75.1 110.78 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . 0.588 HG11 ' CE3' ' A' ' 175' ' ' TRP . 0.2 OUTLIER -123.35 -179.06 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.923 -0.581 . . . . 43.13 110.923 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.516 HD11 ' HB2' ' A' ' 175' ' ' TRP . 4.4 pt -57.16 161.37 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.316 -0.402 . . . . 53.04 111.382 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 31.8 ttm180 -69.7 -25.43 63.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 72.14 111.036 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -78.63 -38.55 23.98 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.743 -0.742 . . . . 51.44 112.187 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.648 ' HD1' HD23 ' A' ' 190' ' ' LEU . 3.4 t90 -75.66 -32.36 60.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.902 0.382 . . . . 64.52 111.36 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -72.04 -33.54 68.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.038 -0.528 . . . . 64.54 110.817 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -74.52 -28.98 61.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.115 -0.493 . . . . 63.13 110.83 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -87.98 -50.69 6.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.272 -0.422 . . . . 63.01 111.257 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.477 ' HG ' ' CD1' ' A' ' 175' ' ' TRP . 8.4 mt -52.55 -37.12 57.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.078 -0.51 . . . . 74.24 110.885 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 6.9 tp -50.97 -26.17 5.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.097 -0.501 . . . . 74.3 111.418 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.52 3.04 55.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.345 . . . . 73.43 111.624 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 4.7 ttt -79.95 148.99 30.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.752 0.311 . . . . 63.43 110.879 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -118.38 169.68 9.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.427 . . . . 73.13 111.26 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.76 118.52 8.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.859 -0.61 . . . . 73.0 110.659 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 68.01 64.1 3.31 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.687 -0.768 . . . . 43.44 112.476 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . 0.513 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 14.2 tt0 -144.02 147.7 34.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.575 0.226 . . . . 71.3 110.5 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . 0.529 ' HG2' HD13 ' A' ' 116' ' ' LEU . 6.1 tttt -115.94 132.83 56.53 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.066 -0.346 . . . . 74.14 110.066 179.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . 0.822 ' HA ' HD12 ' A' ' 116' ' ' LEU . . . -140.57 170.34 15.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.072 0.463 . . . . 73.25 111.729 -179.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . 0.568 ' HD3' HG23 ' A' ' 215' ' ' THR . 0.2 OUTLIER -123.08 101.39 7.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.653 -0.703 . . . . 72.05 109.892 179.548 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.648 HD23 ' HD1' ' A' ' 175' ' ' TRP . 4.9 mp -99.32 118.17 35.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.044 0.45 . . . . 75.3 112.106 -178.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.87 ' HG2' HG23 ' A' ' 215' ' ' THR . 9.4 mt-10 -110.72 107.71 17.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.666 -0.697 . . . . 62.44 109.574 178.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.454 HG12 ' CE2' ' A' ' 216' ' ' PHE . 3.6 mm -98.29 141.77 15.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.012 0.434 . . . . 74.01 111.639 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.402 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 2.0 mt-10 -81.53 166.66 36.65 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.868 -0.606 . . . . 70.31 110.372 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 21.1 Cg_endo -60.84 -48.72 9.96 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.427 2.084 . . . . 74.53 112.302 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -51.62 -26.32 8.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 54.52 111.442 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.441 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 10.1 m0 -117.61 37.02 4.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.487 -0.324 . . . . 75.44 111.216 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -158.01 -82.9 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.5 -0.318 . . . . 70.42 111.471 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . 0.782 ' CD2' HG21 ' A' ' 208' ' ' ILE . 22.7 m-85 -99.61 -30.36 12.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.855 0.36 . . . . 75.42 111.021 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 103.31 175.46 26.29 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.811 -0.709 . . . . 70.34 112.67 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 7.9 ttmt -57.6 -40.05 78.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.881 0.372 . . . . 74.32 110.848 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -44.6 96.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.059 -0.519 . . . . 70.22 110.607 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 109.14 -154.31 16.53 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.851 -0.69 . . . . 70.32 112.487 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.444 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.6 OUTLIER -139.82 87.3 12.91 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.718 0.294 . . . . 63.13 110.703 179.932 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.11 -22.12 67.64 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.54 2.16 . . . . 74.25 112.471 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.61 -42.11 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.882 0.372 . . . . 72.35 110.866 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -109.79 23.32 14.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.112 -0.494 . . . . 72.12 111.401 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt 56.36 54.4 7.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.859 0.361 . . . . 61.24 111.067 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 1.019 HD12 HD21 ' A' ' 139' ' ' LEU . 20.2 mm -110.57 111.71 57.0 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 74.33 111.055 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.08 161.05 7.14 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.43 2.086 . . . . 50.32 112.342 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.18 129.35 15.97 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.594 2.196 . . . . 75.24 112.313 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 67.86 37.09 3.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.335 -0.393 . . . . 73.4 110.918 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -91.75 157.45 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.256 -0.429 . . . . 72.21 111.326 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.5 155.97 18.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 62.13 110.507 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.654 HD11 ' CD2' ' A' ' 198' ' ' TYR . 32.4 mt -136.21 109.26 7.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.905 0.383 . . . . 75.54 111.314 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.87 HG23 ' HG2' ' A' ' 191' ' ' GLU . 38.6 m -109.71 137.04 48.09 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.075 -0.511 . . . . 42.24 110.941 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.614 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 13.7 p90 -153.6 178.02 10.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 61.54 111.039 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . 0.457 ' OE2' HD21 ' A' ' 116' ' ' LEU . 10.9 mt-10 -134.07 137.64 44.77 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.926 -0.579 . . . . 70.12 110.541 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.61 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.3 t -120.75 150.97 23.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.131 0.491 . . . . 74.13 111.976 -178.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -136.72 107.58 6.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.612 -0.722 . . . . 75.31 109.953 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.555 HD21 ' CG1' ' A' ' 223' ' ' ILE . 1.0 OUTLIER -70.84 130.57 42.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.433 -0.349 . . . . 70.21 110.913 -179.672 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 25.3 t -107.35 -31.47 2.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.351 -0.386 . . . . 72.21 111.465 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -169.56 160.58 9.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.884 0.373 . . . . 73.1 111.235 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.714 HG23 HG12 ' A' ' 131' ' ' VAL . 44.7 mt -140.56 110.02 3.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.111 -0.495 . . . . 54.24 111.028 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . 0.557 ' C ' HG12 ' A' ' 130' ' ' VAL . 2.4 m-20 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 61.13 110.911 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.867 0.365 . . . . 74.41 111.222 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.38 168.28 1.58 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 61.1 111.108 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -144.97 108.41 4.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 61.22 111.152 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 59.6 89.81 0.06 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 54.34 111.138 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.979 HG11 HG21 ' A' ' 136' ' ' THR . 39.2 t -60.07 111.27 3.7 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.185 -0.461 . . . . 71.32 110.965 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.454 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 73.7 Cg_endo -76.48 136.44 17.5 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.654 2.236 . . . . 75.53 112.382 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.528 ' CD ' HD11 ' A' ' 149' ' ' ILE . 2.3 tp-100 -80.66 152.91 28.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.453 . . . . 74.14 110.867 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.7 114.55 1.18 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 72.44 111.173 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -87.75 -38.49 15.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.092 -0.503 . . . . 72.14 110.843 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.595 ' CE2' HD11 ' A' ' 20' ' ' LEU . 1.7 m-90 -112.79 173.69 6.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.955 -0.566 . . . . 63.35 110.708 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -115.09 150.86 35.3 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.063 -0.517 . . . . 75.05 110.69 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.476 HG12 ' HD2' ' A' ' 16' ' ' ARG . 39.2 t -56.04 -32.81 34.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.012 0.434 . . . . 72.14 110.668 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -75.62 -24.68 56.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.803 -0.635 . . . . 74.21 110.969 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.04 -57.46 3.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.85 0.357 . . . . 70.24 110.803 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.515 ' CB ' HG22 ' A' ' 60' ' ' VAL . 0.9 OUTLIER -49.66 -63.41 1.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.28 -0.418 . . . . 70.03 110.952 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.581 ' CG ' HG21 ' A' ' 60' ' ' VAL . 24.4 mtp180 -53.84 -24.38 15.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 61.45 111.194 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.9 177.46 0.15 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.009 0.433 . . . . 74.14 111.255 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -110.38 17.08 21.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.826 -0.625 . . . . 62.44 111.151 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -106.83 -24.76 11.96 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.527 -0.306 . . . . 64.51 111.263 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.614 HD22 HD11 ' A' ' 25' ' ' ILE . 6.3 tt -93.98 117.8 67.21 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.517 -0.31 . . . . 72.31 111.051 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.42 ' N ' HD23 ' A' ' 20' ' ' LEU . 31.5 Cg_exo -59.07 127.2 23.35 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.419 2.079 . . . . 73.53 112.076 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -24.13 67.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 74.52 111.162 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HA ' HD12 ' A' ' 26' ' ' ILE . 15.4 ptpt -53.91 -39.73 66.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.343 -0.389 . . . . 63.41 111.523 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -73.74 -55.09 6.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.896 0.379 . . . . 70.33 111.015 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.622 ' O ' HD12 ' A' ' 29' ' ' LEU . 28.7 mt -44.71 -33.65 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.862 -0.608 . . . . 64.23 111.379 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.741 HG12 HD21 ' A' ' 59' ' ' LEU . 6.8 mt -76.02 -39.87 37.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 74.3 110.868 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.2 mtpt -72.15 -26.15 61.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.976 -0.556 . . . . 72.2 111.044 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.486 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 33.8 t80 -69.57 -44.63 70.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.05 0.452 . . . . 75.12 110.742 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.691 HD21 ' HA ' ' A' ' 63' ' ' TYR . 2.9 mt -71.7 -24.39 61.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.705 -0.68 . . . . 65.3 110.992 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -76.38 -24.11 54.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.298 -0.41 . . . . 73.24 110.703 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -103.39 -10.19 18.82 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.253 -0.43 . . . . 73.51 111.125 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.486 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 12.1 m170 -116.58 -11.2 11.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.405 -0.361 . . . . 72.54 111.324 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -121.06 165.27 14.15 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.708 -0.758 . . . . 55.2 112.42 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -92.6 150.88 20.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.606 0.241 . . . . 74.25 110.515 179.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.562 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.2 p-10 -48.9 -57.08 7.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.758 0.313 . . . . 61.52 110.941 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.5 m -47.94 -51.97 21.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.018 0.437 . . . . 54.15 110.736 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.493 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 12.5 t80 -52.94 -47.4 68.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.745 -0.662 . . . . 74.22 110.277 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.519 HD22 ' HB3' ' A' ' 43' ' ' LEU . 14.1 mt -65.36 -40.69 93.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.915 -0.584 . . . . 74.42 110.674 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.833 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -49.59 -43.25 46.2 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.227 -0.442 . . . . 54.11 111.063 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -58.01 -29.32 65.2 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.868 -0.606 . . . . 72.13 110.74 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 -112.82 12.02 19.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 55.32 111.102 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 54.44 37.45 27.76 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.866 0.365 . . . . 71.01 110.748 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.679 HD21 HD23 ' A' ' 59' ' ' LEU . 15.3 mt -94.37 -20.95 19.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 74.34 111.895 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.833 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -78.15 155.53 30.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.099 0.476 . . . . 75.25 111.153 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.92 -124.67 6.1 Favored Glycine 0 N--CA 1.451 -0.302 0 CA-C-N 115.638 -0.71 . . . . 64.55 112.43 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.757 ' O ' HG23 ' A' ' 50' ' ' VAL . 8.0 m120 -116.4 119.31 35.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.796 0.331 . . . . 64.41 110.969 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.708 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -45.69 -52.56 2.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.17 -0.468 . . . . 74.03 111.4 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 pttp -47.7 -37.09 12.34 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.909 -0.587 . . . . 74.22 110.842 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -85.58 -26.6 26.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.866 -0.606 . . . . 73.21 110.931 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.757 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.5 t -78.59 -26.06 13.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.238 -0.437 . . . . 64.5 111.345 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.33 -25.39 67.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.428 -0.351 . . . . 63.44 111.103 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -95.17 -27.62 15.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 71.31 110.803 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -100.32 33.84 2.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.486 . . . . 74.4 111.012 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -166.76 135.57 2.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 72.21 110.984 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.401 ' H ' ' HB2' ' A' ' 58' ' ' HIS . 14.7 p30 -94.63 177.7 5.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.271 -0.422 . . . . 72.21 110.974 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.558 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -56.62 -57.82 10.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.315 -0.402 . . . . 74.33 110.929 -179.883 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.54 -26.94 64.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.057 -0.519 . . . . 64.04 110.602 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.401 ' HB2' ' H ' ' A' ' 55' ' ' ASN . 0.1 OUTLIER -63.01 -45.69 91.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.023 -0.535 . . . . 75.13 110.793 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.741 HD21 HG12 ' A' ' 26' ' ' ILE . 23.9 mt -73.82 -29.03 61.92 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.714 -0.675 . . . . 75.43 111.202 -179.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.581 HG21 ' CG ' ' A' ' 16' ' ' ARG . 21.1 t -81.08 -43.98 20.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.901 0.382 . . . . 71.32 111.057 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.0 m -59.95 -33.14 71.52 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.971 -0.559 . . . . 71.43 110.695 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.436 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -84.46 -23.12 30.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 72.52 111.129 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.691 ' HA ' HD21 ' A' ' 29' ' ' LEU . 82.2 t80 -83.78 -23.03 31.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.257 -0.429 . . . . 71.3 110.981 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.502 ' ND2' HG12 ' A' ' 60' ' ' VAL . 42.9 m-20 -81.79 -55.07 4.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 75.23 111.419 -179.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.493 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 4.2 p-80 -61.65 -29.8 70.3 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.153 -0.476 . . . . 71.23 111.296 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.715 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.1 tt -50.2 -40.01 45.88 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.891 0.377 . . . . 64.32 111.194 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -79.03 -38.75 35.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.52 . . . . 74.41 110.695 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.45 -41.15 93.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.941 -0.572 . . . . 75.14 110.768 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.2 p -92.64 -2.61 55.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.936 -0.574 . . . . 60.3 111.462 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.13 38.77 10.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.768 0.318 . . . . 73.22 111.353 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.444 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 45.3 mtt-85 -93.13 43.68 1.13 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.308 -0.406 . . . . 72.14 110.992 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.529 ' HA ' HD21 ' A' ' 66' ' ' LEU . 89.8 m-85 -64.5 178.71 0.7 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 75.43 110.826 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.4 ttmm -68.79 153.03 44.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.28 -0.418 . . . . 74.2 110.923 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.02 -102.47 2.8 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.731 -0.747 . . . . 74.33 112.494 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.46 95.14 1.99 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.83 0.347 . . . . 73.2 110.913 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -110.66 -33.05 6.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 55.05 110.913 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.526 ' O ' HG23 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -101.23 100.43 10.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 53.33 110.924 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.526 HG23 ' O ' ' A' ' 77' ' ' SER . 2.1 pt -158.57 170.78 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 72.42 111.192 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.5 m -65.47 -31.5 72.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.234 -0.439 . . . . 65.43 110.9 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 25.1 mtpt 60.67 111.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 65.43 110.885 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 27.3 t -99.51 -31.29 3.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 74.23 111.105 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.7 m -97.77 164.89 12.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.461 . . . . 72.21 110.919 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -106.54 169.9 8.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 31.3 110.868 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 60.47 31.88 20.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 74.52 110.839 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 19.8 t 69.09 -67.7 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.179 -0.464 . . . . 74.02 111.226 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -129.32 157.87 40.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.957 -0.565 . . . . 72.41 110.909 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 15.2 m-20 -145.86 109.39 4.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.186 -0.461 . . . . 73.11 110.945 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.8 m -110.33 -30.27 2.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.435 . . . . 72.02 111.17 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.71 -31.37 11.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.444 . . . . 63.3 110.921 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.4 tp -91.53 102.69 15.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.437 . . . . 52.31 110.909 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -129.52 139.5 51.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 72.55 110.883 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -109.1 -35.65 6.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 73.05 110.935 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -177.42 37.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 72.12 110.927 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 60.62 88.73 0.12 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 72.14 110.849 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -68.87 116.56 4.52 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.514 2.143 . . . . 71.43 112.307 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -91.01 163.75 14.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.469 . . . . 73.41 110.877 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -118.04 128.45 54.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 71.22 110.902 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.7 m -123.13 147.31 46.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.479 . . . . 73.43 110.887 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -177.66 -39.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 70.35 110.937 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 73.6 m 60.69 159.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.104 -0.498 . . . . 71.14 110.966 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -168.99 74.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 75.3 110.849 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -156.44 173.75 16.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 72.05 110.928 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.0 p -147.31 108.84 4.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 72.43 110.879 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.548 HD23 ' N ' ' A' ' 105' ' ' ASP . 1.1 tt -108.27 152.13 25.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 75.44 110.948 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.548 ' N ' HD23 ' A' ' 104' ' ' LEU . 2.4 m-20 -164.27 -44.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 74.43 111.003 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -122.11 -40.84 2.47 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.09 -0.505 . . . . 72.42 110.954 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 136.57 77.73 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.803 -0.713 . . . . 61.35 112.516 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -69.38 171.05 14.73 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.574 2.183 . . . . 72.24 112.311 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.442 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 32.3 Cg_endo -64.29 -166.19 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.59 2.194 . . . . 61.12 112.253 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.448 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -97.17 30.22 2.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 64.23 111.018 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.442 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 20.3 p90 -157.83 161.93 38.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.299 -0.409 . . . . 74.52 110.84 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 12.2 m -131.46 103.49 6.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 64.13 111.043 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.66 ' HD2' ' HB1' ' A' ' 178' ' ' ALA . 13.8 tttm -109.59 151.49 26.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 74.24 110.705 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.459 ' O ' HD12 ' A' ' 116' ' ' LEU . 2.1 m -143.31 128.47 18.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 61.43 110.874 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.607 ' O ' HG13 ' A' ' 115' ' ' VAL . 9.2 p -78.55 106.34 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.247 -0.433 . . . . 75.35 111.14 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.459 HD12 ' O ' ' A' ' 114' ' ' SER . 6.8 mp -78.94 -78.01 0.16 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.208 -0.451 . . . . 74.23 110.79 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -86.73 108.07 18.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 73.4 110.753 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.44 121.88 12.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.47 . . . . 70.5 111.049 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -100.03 -159.52 28.41 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.74 -0.743 . . . . 71.35 112.139 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.416 ' O ' ' HB2' ' A' ' 121' ' ' LYS . 0.5 OUTLIER -36.11 -48.87 0.63 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.876 0.369 . . . . 73.02 111.572 -179.479 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 120' ' ' ASP . 20.6 mtpt 67.58 36.9 3.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.845 -0.616 . . . . 54.32 110.349 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -153.91 -44.91 0.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.758 -0.656 . . . . 64.05 110.676 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -88.86 98.47 11.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.14 -0.482 . . . . 74.12 110.853 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -110.61 146.19 33.85 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 65.15 110.842 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.617 ' CB ' HG11 ' A' ' 166' ' ' VAL . 51.7 Cg_exo -54.56 125.55 19.35 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.511 2.141 . . . . 63.44 112.453 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.99 152.22 20.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.109 -0.496 . . . . 74.51 110.8 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -55.22 111.59 0.89 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.243 -0.435 . . . . 62.34 110.881 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 99.8 -10.82 60.79 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.742 -0.742 . . . . 60.11 112.708 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -86.92 134.49 33.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.877 0.37 . . . . 70.31 110.953 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.545 HG22 ' N ' ' A' ' 131' ' ' VAL . 7.1 p -70.65 163.38 3.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 73.11 110.989 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.871 HG22 ' O ' ' A' ' 164' ' ' PHE . 15.7 m -155.05 146.55 13.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.241 -0.436 . . . . 74.24 111.017 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.463 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.89 117.91 22.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.735 0.302 . . . . 72.22 110.891 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.47 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 22.3 p -152.48 166.63 31.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 73.43 111.13 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.57 ' HB3' HD13 ' A' ' 149' ' ' ILE . 19.1 m95 -101.92 164.22 11.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.056 -0.52 . . . . 73.23 110.239 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.401 ' CD1' ' OD1' ' A' ' 148' ' ' ASN . 28.6 p90 -160.38 135.16 7.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.072 0.463 . . . . 75.04 111.867 -179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.979 HG21 HG11 ' A' ' 5' ' ' VAL . 2.9 m -124.74 109.52 13.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.707 -0.679 . . . . 74.41 110.248 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.67 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.55 144.98 17.55 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.613 -0.803 . . . . 51.4 113.414 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.785 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.79 149.51 29.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.863 0.363 . . . . 33.42 110.825 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.81 HD21 HD12 ' A' ' 208' ' ' ILE . 22.7 mt -88.05 -176.37 5.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 72.21 110.845 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -55.87 -43.58 77.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.356 -0.383 . . . . 73.03 110.899 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -80.07 -16.78 54.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.945 -0.57 . . . . 73.32 111.161 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 107.31 25.86 5.91 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.724 -0.751 . . . . 32.54 112.589 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.5 m -82.06 112.72 19.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.776 0.322 . . . . 73.42 110.867 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 21.9 t -66.41 126.78 26.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 62.54 111.171 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.689 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 38.7 p90 -114.36 -28.29 7.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.223 -0.444 . . . . 72.2 111.171 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . 0.421 ' HB2' ' CE1' ' A' ' 145' ' ' PHE . 51.6 m-20 -156.24 111.43 2.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.384 -0.371 . . . . 71.14 110.888 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.633 HG23 HG23 ' A' ' 136' ' ' THR . 61.6 m -142.84 108.88 5.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 25.02 111.096 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.401 ' OD1' ' CD1' ' A' ' 135' ' ' TYR . 20.0 p-10 -102.76 25.6 9.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.428 . . . . 71.03 110.909 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.57 HD13 ' HB3' ' A' ' 134' ' ' TRP . 9.0 mm -82.03 93.44 2.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.342 -0.39 . . . . 71.22 110.83 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.401 ' HB3' ' HB1' ' A' ' 159' ' ' ALA . 0.0 OUTLIER -94.8 -171.97 2.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 74.24 110.849 -179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.81 165.97 2.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 73.0 110.971 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.65 162.2 27.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 64.23 110.924 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.02 -36.98 29.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 54.21 111.092 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 11.1 mmtt -60.01 -33.19 71.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 70.44 110.904 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.6 tttp -86.12 -63.14 1.37 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.009 0.433 . . . . 64.52 110.946 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 29.1 tttt -120.88 149.67 42.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.853 -0.612 . . . . 75.22 110.884 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.87 31.35 3.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 61.33 110.911 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -119.51 44.23 2.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 63.24 110.878 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.401 ' HB1' ' HB3' ' A' ' 150' ' ' GLN . . . -155.43 128.28 8.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 74.53 111.097 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 15.4 mttp -146.4 147.7 31.82 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.901 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.95 158.2 57.51 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.6 2.2 . . . . 73.22 112.301 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 1.6 tt -76.43 123.6 26.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 64.13 110.451 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.632 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.3 122.35 42.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.951 0.405 . . . . 64.35 111.411 -179.851 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.871 ' O ' HG22 ' A' ' 131' ' ' VAL . 6.5 p90 -150.98 143.41 24.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 75.04 110.508 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.63 ' O ' HG12 ' A' ' 168' ' ' VAL . 7.3 mtmt -82.25 141.64 32.79 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.079 0.466 . . . . 74.14 111.226 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.617 HG11 ' CB ' ' A' ' 125' ' ' PRO . 33.4 m -87.57 149.15 4.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.779 -0.646 . . . . 63.52 111.167 -179.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.74 24.8 75.43 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.857 -0.687 . . . . 51.52 112.456 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.693 HG22 ' O ' ' A' ' 168' ' ' VAL . 8.4 p -131.69 40.93 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.846 0.355 . . . . 73.35 111.103 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 40.6 34.18 0.68 Allowed Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.996 -0.621 . . . . 51.12 112.942 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.24 -34.26 32.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.053 0.454 . . . . 64.43 110.411 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.8 m -127.34 179.72 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.799 -0.637 . . . . 72.03 110.83 179.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.596 ' CD1' HD13 ' A' ' 192' ' ' ILE . 4.1 pt -58.72 163.84 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.442 -0.344 . . . . 70.04 111.091 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -71.13 -29.21 64.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 65.02 111.197 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.12 -38.09 41.06 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.671 -0.776 . . . . 73.43 112.279 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.734 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.2 t90 -75.22 -32.65 61.21 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.851 0.357 . . . . 75.52 110.996 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -61.94 -43.95 97.79 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 62.53 110.524 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -68.35 -30.82 69.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.903 -0.59 . . . . 73.1 110.751 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.737 ' O ' HG22 ' A' ' 181' ' ' THR . . . -78.0 -61.97 1.83 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.202 -0.454 . . . . 65.23 111.379 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.704 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 6.7 mt -56.07 -31.71 63.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.043 -0.526 . . . . 75.33 111.102 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 35.0 tp -59.49 -32.63 70.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.375 -0.375 . . . . 74.22 111.036 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . 0.737 HG22 ' O ' ' A' ' 178' ' ' ALA . 12.8 t -92.75 -0.65 57.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.327 -0.397 . . . . 74.13 111.479 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.481 ' HE3' ' C ' ' A' ' 218' ' ' VAL . 0.0 OUTLIER -73.26 152.12 41.13 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.698 0.285 . . . . 62.0 110.871 179.905 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.48 162.61 15.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.296 -0.411 . . . . 74.3 111.107 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . 0.635 ' HA ' HD22 ' A' ' 220' ' ' LEU . 1.2 tttm -61.38 119.42 8.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.924 -0.58 . . . . 53.33 111.144 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 76.03 17.79 79.82 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.99 -0.624 . . . . 71.44 113.042 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . 0.538 ' CD ' HG23 ' A' ' 115' ' ' VAL . 1.1 tt0 -96.72 145.99 25.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.873 0.368 . . . . 71.41 111.105 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt -117.33 136.88 52.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 62.2 110.01 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -149.77 176.12 10.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.033 0.444 . . . . 53.55 111.808 -179.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.11 136.27 36.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.691 -0.686 . . . . 63.03 109.572 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.71 HD21 ' CE1' ' A' ' 216' ' ' PHE . 1.4 pt? -140.25 140.42 35.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.141 0.496 . . . . 62.32 112.217 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.739 ' HB3' HG23 ' A' ' 215' ' ' THR . 0.0 OUTLIER -117.74 106.02 12.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.609 -0.723 . . . . 53.14 110.034 179.113 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.596 HD13 ' CD1' ' A' ' 172' ' ' ILE . 4.2 mt -96.52 148.36 5.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.999 0.428 . . . . 60.12 111.582 -179.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.425 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.6 OUTLIER -81.69 167.51 30.76 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 115.765 -0.652 . . . . 65.4 110.477 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . 0.425 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 18.1 Cg_endo -60.1 -39.84 66.05 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.462 2.108 . . . . 64.13 112.222 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.12 -22.72 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.172 -0.467 . . . . 65.02 111.449 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.448 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 8.9 m0 -118.03 37.01 4.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.687 0.28 . . . . 72.32 111.399 -179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -155.43 -84.56 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.414 -0.357 . . . . 74.01 111.362 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . 0.459 ' HD2' HG21 ' A' ' 208' ' ' ILE . 41.4 m-85 -106.0 -27.95 10.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.905 0.384 . . . . 75.21 110.828 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 107.28 178.9 22.55 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.846 -0.692 . . . . 71.33 112.836 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -59.61 -36.22 75.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.826 0.346 . . . . 74.44 110.892 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.6 -50.03 75.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 64.12 110.658 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.3 -153.38 17.25 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.86 -0.686 . . . . 70.05 112.595 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.446 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 2.0 tm0? -152.15 84.26 4.9 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.837 0.351 . . . . 72.51 110.515 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -49.99 -44.43 37.34 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.762 2.308 . . . . 72.31 112.783 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.72 -42.12 71.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 65.24 111.012 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.689 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -96.43 27.37 3.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.031 -0.531 . . . . 61.24 111.29 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt 49.19 30.65 3.15 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.889 0.376 . . . . 61.33 111.057 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.81 HD12 HD21 ' A' ' 139' ' ' LEU . 20.8 mm -94.8 111.75 55.49 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.098 -0.501 . . . . 73.14 111.188 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . 0.561 ' HG2' ' HB2' ' A' ' 212' ' ' ALA . 55.9 Cg_endo -69.95 171.04 15.4 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.405 2.07 . . . . 54.14 112.201 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.79 120.95 8.33 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.512 2.141 . . . . 74.24 112.228 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . 0.405 ' HA ' ' HG3' ' A' ' 194' ' ' PRO . 49.2 m-80 63.4 70.38 0.53 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.173 -0.467 . . . . 72.24 110.859 -179.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . 0.561 ' HB2' ' HG2' ' A' ' 209' ' ' PRO . . . -122.42 154.7 37.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.183 -0.462 . . . . 72.42 111.336 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . 0.723 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.0 OUTLIER -90.42 149.43 22.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.019 -0.537 . . . . 71.23 110.448 179.646 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.723 HD23 ' O ' ' A' ' 213' ' ' LYS . 9.0 mt -131.5 109.72 10.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.857 0.361 . . . . 75.22 111.313 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.739 HG23 ' HB3' ' A' ' 191' ' ' GLU . 1.4 m -110.11 140.49 44.13 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.057 -0.519 . . . . 74.21 110.779 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.71 ' CE1' HD21 ' A' ' 190' ' ' LEU . 23.2 p90 -155.92 -179.67 8.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.077 0.465 . . . . 75.14 111.374 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . 0.417 ' HB3' ' HB2' ' A' ' 7' ' ' GLN . 4.1 mt-10 -132.89 136.61 46.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.72 -0.673 . . . . 73.15 110.256 179.41 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.734 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.8 t -120.99 150.31 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.018 0.437 . . . . 74.14 111.792 -178.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -136.23 108.51 7.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.809 -0.632 . . . . 71.24 110.27 179.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.696 HD21 HG13 ' A' ' 223' ' ' ILE . 2.2 tt -70.05 129.55 39.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.332 -0.394 . . . . 64.1 110.91 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 29.6 t -105.99 -31.7 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.169 -0.469 . . . . 74.25 111.483 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . 0.414 ' N ' HD23 ' A' ' 220' ' ' LEU . 5.4 t70 -170.3 161.14 8.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.93 0.395 . . . . 74.31 111.219 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.821 HG23 HG12 ' A' ' 131' ' ' VAL . 38.4 mt -140.85 110.21 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.053 -0.521 . . . . 65.31 111.003 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . 0.525 ' C ' HG12 ' A' ' 130' ' ' VAL . 2.7 m-20 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 63.33 110.875 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.814 0.34 . . . . 74.34 111.233 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -133.17 71.4 1.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 64.05 111.111 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -175.58 73.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 73.32 111.088 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -94.97 174.27 7.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 50.11 111.126 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.934 HG11 HG21 ' A' ' 136' ' ' THR . 31.4 t -60.08 110.13 2.58 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.487 . . . . 42.24 110.94 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -82.9 153.64 14.86 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.637 2.224 . . . . 55.52 112.607 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.53 ' NE2' HD11 ' A' ' 149' ' ' ILE . 3.0 tp60 -86.38 152.84 22.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 65.02 110.825 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.75 127.03 28.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 54.45 111.134 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -95.58 -31.43 13.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 54.31 110.892 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.455 ' CD1' HD11 ' A' ' 20' ' ' LEU . 3.0 m-90 -114.23 173.62 6.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.046 -0.525 . . . . 74.12 110.732 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 m -115.55 152.3 33.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.044 -0.526 . . . . 53.22 110.708 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.434 HG11 ' CE ' ' A' ' 155' ' ' LYS . 49.1 t -56.24 -34.01 38.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 62.1 110.691 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -73.34 -25.28 60.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.968 -0.56 . . . . 74.44 111.147 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -82.01 -56.55 3.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.821 0.343 . . . . 54.15 110.942 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.687 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.3 mt -49.49 -64.64 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 73.41 111.17 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.502 ' HG3' HG11 ' A' ' 60' ' ' VAL . 34.6 mtp85 -54.11 -25.0 19.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 64.03 111.229 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.96 176.62 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.0 0.429 . . . . 71.53 111.293 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -110.34 17.01 21.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.878 -0.601 . . . . 74.24 111.175 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -112.7 -23.45 10.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.554 -0.294 . . . . 73.32 111.222 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.717 HD22 HD11 ' A' ' 25' ' ' ILE . 10.2 tt -90.07 114.03 59.38 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.509 -0.314 . . . . 71.31 110.99 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -57.92 125.3 18.18 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.493 2.129 . . . . 63.11 112.303 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -24.19 67.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 71.23 111.245 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.499 ' HA ' HD12 ' A' ' 26' ' ' ILE . 29.5 mmtt -52.69 -35.16 54.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.397 . . . . 73.45 111.37 -179.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.91 -56.59 4.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.283 -0.417 . . . . 73.15 111.109 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.717 HD11 HD22 ' A' ' 20' ' ' LEU . 40.4 mt -44.79 -32.86 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.896 -0.593 . . . . 72.53 111.474 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.699 HG12 HD21 ' A' ' 59' ' ' LEU . 9.4 mt -75.19 -41.72 44.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.964 0.412 . . . . 45.12 110.907 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -71.55 -25.02 62.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.874 -0.603 . . . . 74.42 111.116 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -70.03 -44.71 68.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.042 0.448 . . . . 62.12 110.761 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.782 HD23 HD12 ' A' ' 66' ' ' LEU . 7.7 mt -72.17 -21.42 61.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.728 -0.669 . . . . 71.21 111.101 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -83.87 -25.78 29.98 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.356 -0.384 . . . . 72.25 111.066 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -100.97 -1.01 35.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.422 -0.354 . . . . 70.52 111.512 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.422 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.9 m-70 -131.95 -6.47 3.53 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.697 0.258 . . . . 61.1 111.697 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.87 164.43 13.07 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.735 -0.745 . . . . 22.0 112.357 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 54.5 p -91.53 147.94 22.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.584 0.23 . . . . 60.33 110.553 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.727 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -48.16 -57.03 6.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.798 0.332 . . . . 54.4 110.991 -179.77 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.9 m -48.67 -50.03 34.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.083 0.468 . . . . 74.51 110.574 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.479 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 36.5 t80 -53.6 -48.76 68.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.695 -0.684 . . . . 52.55 110.404 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.409 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 15.8 mt -65.01 -40.46 94.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.936 -0.575 . . . . 63.23 110.719 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.744 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.17 -47.68 23.89 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.046 0.45 . . . . 75.53 111.098 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -58.09 -26.14 62.2 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.72 -0.673 . . . . 64.4 110.842 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.445 ' O ' ' CG ' ' A' ' 42' ' ' LYS . 52.5 m-70 -112.4 10.57 19.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.265 -0.425 . . . . 74.1 111.239 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.445 ' CG ' ' O ' ' A' ' 41' ' ' HIS . 6.0 ptpt 49.18 35.28 7.08 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.954 0.406 . . . . 63.23 110.995 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.747 HD13 HD13 ' A' ' 29' ' ' LEU . 19.0 mt -93.51 -20.44 20.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.959 -0.564 . . . . 72.23 111.574 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.744 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -79.32 159.26 27.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.026 0.441 . . . . 71.23 111.147 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.56 -120.53 4.97 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 115.775 -0.648 . . . . 60.0 112.482 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.764 ' O ' HG23 ' A' ' 50' ' ' VAL . 46.6 m-80 -116.37 116.12 27.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.826 0.346 . . . . 74.21 110.878 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.662 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.83 -55.57 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.164 -0.471 . . . . 73.23 111.407 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.3 ptpt -46.95 -36.85 8.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.855 -0.611 . . . . 63.41 110.988 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -85.76 -25.47 26.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.939 -0.573 . . . . 72.22 111.067 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.764 HG23 ' O ' ' A' ' 46' ' ' ASN . 28.3 t -83.09 -25.92 7.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.365 -0.379 . . . . 74.01 111.403 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.11 -16.29 63.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.426 -0.352 . . . . 34.4 111.474 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.32 -34.3 12.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.808 0.337 . . . . 34.41 110.895 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.586 HG22 ' HA ' ' A' ' 50' ' ' VAL . 7.4 t -86.95 -30.14 21.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.199 -0.455 . . . . 51.23 111.038 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.13 126.64 40.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 33.1 111.142 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -82.0 177.04 9.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 65.01 110.683 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.574 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -58.84 -58.24 9.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.91 0.386 . . . . 75.44 110.541 179.912 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.17 -27.32 68.99 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.055 -0.52 . . . . 64.04 110.582 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.59 -40.61 95.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.067 -0.515 . . . . 70.41 110.399 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.699 HD21 HG12 ' A' ' 26' ' ' ILE . 20.3 mt -76.59 -31.12 57.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.743 -0.662 . . . . 73.33 110.936 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.687 HG22 ' HB3' ' A' ' 15' ' ' LEU . 21.7 t -77.75 -42.73 29.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.995 0.426 . . . . 73.1 110.68 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 53.6 m -60.51 -35.46 76.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.885 -0.598 . . . . 74.31 110.398 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.448 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -79.54 -22.06 44.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.981 -0.554 . . . . 61.4 110.823 179.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.682 ' HA ' HD21 ' A' ' 29' ' ' LEU . 20.4 t80 -83.69 -22.94 31.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.066 -0.516 . . . . 74.43 110.837 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.522 ' ND2' HG12 ' A' ' 60' ' ' VAL . 43.6 m-80 -85.73 -53.74 4.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.17 0.509 . . . . 73.4 110.809 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.479 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 1.6 p-80 -59.97 -24.14 64.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.86 -0.609 . . . . 72.02 110.788 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.782 HD12 HD23 ' A' ' 29' ' ' LEU . 0.6 OUTLIER -44.93 -45.99 10.74 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.016 0.436 . . . . 73.01 110.521 179.641 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -79.28 -38.61 34.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.566 -0.743 . . . . 74.31 109.929 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -64.18 -16.24 61.52 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.739 -0.664 . . . . 53.03 111.246 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.86 -11.99 10.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.349 -0.387 . . . . 71.22 111.269 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 51.91 34.63 13.94 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.832 0.348 . . . . 74.35 110.987 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.455 ' CB ' ' CD1' ' A' ' 37' ' ' PHE . 91.6 mtt180 -98.4 46.45 1.0 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 72.43 110.91 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.599 ' CZ ' HD22 ' A' ' 66' ' ' LEU . 82.1 m-85 -71.15 -178.59 2.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.077 -0.511 . . . . 75.54 110.784 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.8 tttp -73.94 141.33 45.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.303 -0.408 . . . . 72.4 110.824 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.41 ' O ' ' N ' ' A' ' 76' ' ' GLU . . . -153.7 142.83 9.5 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.671 -0.776 . . . . 71.01 112.501 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 69.9 p 52.26 -87.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.607 0.242 . . . . 74.23 111.426 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 74' ' ' GLY . 1.6 mm-40 63.91 -79.98 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.793 0.33 . . . . 71.5 110.976 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.2 m -148.63 -78.09 0.15 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.183 -0.462 . . . . 43.31 110.962 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 28.7 mt 69.31 -67.37 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.088 -0.505 . . . . 62.32 111.203 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.1 t -106.14 137.3 44.31 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.957 -0.565 . . . . 75.1 110.912 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.6 mtmp? -161.58 97.71 1.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 75.34 110.897 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.2 m -107.52 174.27 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.458 . . . . 74.04 111.146 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 36.4 p -104.26 177.02 4.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 74.14 110.946 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -147.95 153.81 39.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 62.33 110.895 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -107.26 31.52 5.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.166 -0.47 . . . . 64.4 110.919 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t 59.95 109.53 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 64.4 111.125 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.4 tttm -161.32 -61.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 72.44 110.892 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -146.47 153.76 40.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 60.43 110.908 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.5 t -88.13 96.55 5.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.177 -0.465 . . . . 62.34 111.076 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.6 mtmt -92.86 89.47 6.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 71.34 110.882 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 17.4 mt -101.54 -31.65 10.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 63.13 110.865 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -118.45 116.87 27.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 73.14 110.91 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -91.91 146.87 23.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.19 -0.459 . . . . 73.51 110.954 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -105.75 -33.01 8.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.445 . . . . 65.11 110.93 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -148.78 148.44 27.75 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 71.15 110.873 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.69 118.33 5.59 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.569 2.179 . . . . 72.11 112.282 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 14.9 tttp -112.11 -35.36 5.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 73.21 110.921 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -156.83 144.0 18.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.11 -0.496 . . . . 60.05 110.898 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.09 -68.89 0.21 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 65.0 110.942 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.95 -38.99 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.942 -0.572 . . . . 65.25 110.916 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 59.88 99.81 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.13 -0.487 . . . . 70.41 110.927 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -102.57 -29.98 11.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 64.43 111.009 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.7 ' O ' HG23 ' A' ' 103' ' ' THR . 2.0 mt-10 -99.22 166.89 11.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 75.24 110.907 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.7 HG23 ' O ' ' A' ' 102' ' ' GLU . 0.8 OUTLIER -169.16 115.35 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.154 -0.475 . . . . 63.31 110.85 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 tp -60.17 154.83 18.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 72.52 110.937 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -174.86 -40.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 55.3 110.929 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -99.35 -31.45 11.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.071 -0.513 . . . . 60.42 110.914 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.67 64.28 0.85 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.716 -0.754 . . . . 75.23 112.527 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.19 161.09 47.29 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.581 2.187 . . . . 71.14 112.29 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.431 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 41.6 Cg_exo -56.89 -162.24 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.619 2.213 . . . . 63.31 112.292 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -97.67 37.4 1.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.469 . . . . 74.32 110.949 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.431 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 11.9 p90 -167.29 151.68 6.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 71.14 110.864 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 26.0 m -113.74 129.94 56.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 60.11 110.296 179.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.4 ' CG ' ' HB3' ' A' ' 190' ' ' LEU . 0.1 OUTLIER -129.93 144.14 51.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.973 0.416 . . . . 63.13 111.374 -179.546 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.428 ' O ' HD12 ' A' ' 116' ' ' LEU . 0.4 OUTLIER -139.94 120.86 14.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.919 -0.582 . . . . 61.25 110.461 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.604 ' O ' HG13 ' A' ' 115' ' ' VAL . 10.0 p -76.41 106.26 6.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.917 0.389 . . . . 41.32 111.191 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.455 HD11 ' HB3' ' A' ' 189' ' ' ARG . 6.6 mp -75.74 -75.38 0.18 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 70.41 110.87 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -96.97 107.94 20.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.154 -0.476 . . . . 62.23 110.9 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -58.68 126.29 27.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.166 -0.47 . . . . 73.32 110.937 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -86.26 -174.29 49.49 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.654 -0.784 . . . . 35.33 112.224 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -40.46 -40.95 1.32 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.828 0.347 . . . . 73.23 111.544 -179.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.8 tttp 73.4 43.15 0.38 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.461 . . . . 74.53 110.595 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.0 m -157.3 -45.41 0.07 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.899 -0.592 . . . . 73.31 110.55 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.14 97.55 10.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.07 -0.514 . . . . 71.01 110.692 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 81.4 m-85 -111.11 156.12 41.47 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.078 -0.51 . . . . 74.31 110.834 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.776 ' HB2' HG21 ' A' ' 166' ' ' VAL . 46.9 Cg_endo -68.61 125.6 12.96 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.514 2.143 . . . . 71.14 112.342 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.98 152.16 20.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 73.24 110.937 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -58.84 116.1 3.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 72.51 110.9 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 105.05 -21.92 34.61 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.705 -0.759 . . . . 73.42 112.669 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.3 138.99 31.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.845 0.355 . . . . 74.41 110.828 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.701 HG12 ' HG3' ' A' ' 165' ' ' LYS . 24.4 m -69.59 171.95 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 72.12 111.235 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.896 HG22 ' O ' ' A' ' 164' ' ' PHE . 16.4 m -156.87 145.39 11.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.71 -0.677 . . . . 65.54 110.66 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.439 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.72 117.61 22.25 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.986 -0.285 . . . . 73.34 110.72 179.705 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.657 ' HB3' HD22 ' A' ' 220' ' ' LEU . 31.3 p -153.67 171.44 18.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.004 0.43 . . . . 70.03 111.15 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.51 ' HE1' HG21 ' A' ' 221' ' ' VAL . 10.0 m95 -107.67 161.85 14.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.8 -0.637 . . . . 75.33 110.107 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.489 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 45.1 p90 -161.74 137.19 7.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.07 0.462 . . . . 75.34 111.917 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.934 HG21 HG11 ' A' ' 5' ' ' VAL . 5.4 m -126.72 112.38 15.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.661 -0.699 . . . . 73.35 110.646 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.612 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.67 142.57 16.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.603 -0.808 . . . . 61.45 112.976 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.605 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -147.58 143.87 28.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.8 0.333 . . . . 71.42 110.762 179.79 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.456 HD23 ' HA ' ' A' ' 139' ' ' LEU . 14.2 mt -83.22 -177.63 6.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 73.44 110.977 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -59.29 -43.22 92.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 72.04 110.906 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.81 -7.78 54.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.045 -0.525 . . . . 74.24 111.327 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . 0.442 ' C ' HG22 ' A' ' 138' ' ' THR . . . 92.42 24.12 24.82 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.695 -0.764 . . . . 75.12 112.619 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.41 113.24 25.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.826 0.345 . . . . 52.23 110.777 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 137' ' ' GLY . 8.3 p -63.64 130.95 29.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 55.41 111.162 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.432 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 36.2 p90 -108.95 -28.2 9.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.001 -0.545 . . . . 73.12 110.842 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -168.19 122.23 0.92 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.176 -0.465 . . . . 72.11 110.768 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.549 ' OG1' HG23 ' A' ' 136' ' ' THR . 10.4 t -142.87 124.31 14.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.358 -0.383 . . . . 63.12 111.192 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.489 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 29.9 t30 -91.86 40.85 1.05 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.082 -0.508 . . . . 60.54 110.804 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.53 HD11 ' NE2' ' A' ' 7' ' ' GLN . 6.7 mm -112.68 99.41 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.123 -0.489 . . . . 60.44 110.928 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -96.14 -78.86 0.45 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.306 -0.406 . . . . 74.51 110.979 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 2.8 p -146.53 166.05 27.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.246 -0.433 . . . . 70.53 110.91 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.4 m -74.09 151.63 40.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 74.55 110.863 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.03 -31.25 34.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.149 -0.478 . . . . 53.04 111.166 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -70.23 -34.18 72.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 75.4 111.01 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.434 ' CE ' HG11 ' A' ' 12' ' ' VAL . 0.6 OUTLIER -79.14 -35.79 41.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 70.32 110.889 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.1 mmmt -153.3 155.49 36.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 64.25 110.905 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -98.65 30.4 3.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.2 -0.454 . . . . 63.04 110.924 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -114.72 40.47 2.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 54.12 110.81 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.16 133.25 9.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 65.13 111.097 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -146.38 134.38 10.6 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.255 -0.43 . . . . 73.23 110.837 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.404 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 49.6 Cg_exo -55.37 156.4 17.41 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.446 2.097 . . . . 61.43 112.33 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.535 HD23 ' C ' ' A' ' 162' ' ' LEU . 4.0 tt -74.67 122.96 24.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 74.42 110.429 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.661 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -100.26 121.2 41.09 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.03 0.443 . . . . 74.21 111.48 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.896 ' O ' HG22 ' A' ' 131' ' ' VAL . 7.3 p90 -149.71 140.97 23.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.88 -0.6 . . . . 75.22 110.571 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.701 ' HG3' HG12 ' A' ' 130' ' ' VAL . 72.3 mttt -77.48 136.7 38.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.038 0.447 . . . . 64.44 111.111 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.776 HG21 ' HB2' ' A' ' 125' ' ' PRO . 35.1 m -87.65 149.31 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.822 -0.627 . . . . 54.01 111.084 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 70.87 22.83 78.34 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.786 -0.721 . . . . 75.53 112.565 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.671 HG23 ' HG2' ' A' ' 170' ' ' LYS . 28.9 m -131.06 42.18 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.88 0.371 . . . . 73.43 111.044 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.25 38.57 6.6 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 121.137 -0.554 . . . . 55.44 113.062 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . 0.671 ' HG2' HG23 ' A' ' 168' ' ' VAL . 0.6 OUTLIER -84.34 -47.03 11.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.933 0.397 . . . . 72.0 110.852 179.928 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.9 m -116.91 -179.94 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.943 -0.571 . . . . 62.22 110.913 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.554 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.88 161.44 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.414 -0.357 . . . . 74.42 111.297 -179.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 15.8 ttt85 -69.57 -26.68 64.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.195 -0.457 . . . . 73.13 110.998 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.11 -37.86 36.51 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.772 -0.727 . . . . 64.43 112.029 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.554 ' HB2' ' CG1' ' A' ' 172' ' ' ILE . 1.8 t90 -77.46 -32.9 54.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.024 0.44 . . . . 74.33 111.056 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . 0.639 ' O ' HD13 ' A' ' 180' ' ' LEU . 1.4 m-20 -65.63 -35.47 80.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.802 -0.635 . . . . 73.43 110.479 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -75.97 -29.17 58.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 71.01 110.634 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.582 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -81.92 -54.44 5.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 64.41 111.125 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.574 HD21 HG21 ' A' ' 218' ' ' VAL . 14.5 mt -62.26 -18.92 62.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.883 -0.599 . . . . 75.54 111.186 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.639 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.8 tp -56.46 -23.91 42.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.344 -0.389 . . . . 65.44 111.452 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 16.5 p -112.94 18.13 18.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.596 -0.275 . . . . 71.15 111.585 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.437 ' HG3' HD22 ' A' ' 179' ' ' LEU . 7.4 mmm -77.06 95.18 4.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.831 0.348 . . . . 63.23 111.123 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.3 168.18 7.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 73.12 111.064 -179.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -62.81 113.23 2.92 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.873 -0.603 . . . . 62.31 110.949 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 84.98 0.96 88.99 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 120.854 -0.689 . . . . 54.22 112.91 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.58 137.94 44.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.923 0.392 . . . . 74.44 111.503 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.75 137.41 53.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.976 -0.556 . . . . 71.44 109.766 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -141.83 168.59 19.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.259 0.552 . . . . 70.12 112.132 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . 0.455 ' HB3' HD11 ' A' ' 116' ' ' LEU . 1.4 tmt_? -137.78 101.01 4.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.391 -0.822 . . . . 63.15 109.766 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.582 HD13 ' CB ' ' A' ' 178' ' ' ALA . 0.8 OUTLIER -123.66 149.48 45.39 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.067 0.461 . . . . 71.1 112.011 -178.912 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.638 ' HB3' HG23 ' A' ' 215' ' ' THR . 0.2 OUTLIER -119.37 117.1 27.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.605 -0.725 . . . . 71.12 110.247 179.337 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.633 HD12 ' N ' ' A' ' 192' ' ' ILE . 3.3 mp -98.33 137.85 24.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.969 0.414 . . . . 71.03 111.516 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.41 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.4 mt-10 -71.36 167.56 28.94 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.866 -0.607 . . . . 75.4 110.499 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . 0.41 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 20.8 Cg_endo -60.94 -41.65 43.21 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.391 2.061 . . . . 65.21 112.261 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -53.11 -26.82 17.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 65.23 111.405 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . . . . . . . . . 17.8 m0 -116.1 37.01 3.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.494 -0.321 . . . . 65.23 111.178 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -157.84 -82.3 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.348 -0.387 . . . . 64.24 111.641 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . 0.586 ' CE2' HD13 ' A' ' 208' ' ' ILE . 14.2 m-85 -106.25 -32.9 7.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.907 0.384 . . . . 75.23 110.949 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 106.49 172.55 23.02 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.84 -0.695 . . . . 72.45 112.715 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 33.7 mtmt -61.59 -30.41 70.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.832 0.348 . . . . 73.14 110.902 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -56.16 -52.25 65.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 72.33 110.8 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 109.25 158.33 18.26 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.818 -0.706 . . . . 73.11 112.444 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.747 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.9 OUTLIER -104.76 84.84 1.04 Allowed Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 120.771 0.32 . . . . 64.11 110.758 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.01 -20.15 57.43 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.591 2.194 . . . . 52.4 112.412 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -58.56 -41.89 86.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.368 -0.378 . . . . 45.53 110.891 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.5 28.38 8.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.102 -0.499 . . . . 75.33 111.26 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 7.9 tttt 58.43 54.42 5.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.937 0.399 . . . . 70.24 110.95 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.747 HD12 ' HB3' ' A' ' 203' ' ' GLN . 33.9 mt -115.69 111.77 43.41 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 72.45 111.086 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.1 169.26 2.92 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.568 2.179 . . . . 71.11 112.398 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.27 128.01 12.49 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.636 2.224 . . . . 74.42 112.24 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 65.81 74.22 0.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.31 -0.404 . . . . 51.22 110.758 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.57 153.5 43.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.434 . . . . 74.01 111.365 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.12 139.16 30.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.011 -0.54 . . . . 75.22 110.367 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.447 ' CD1' ' CE2' ' A' ' 198' ' ' TYR . 5.8 mt -120.45 109.48 15.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.922 0.391 . . . . 73.1 111.441 -179.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.638 HG23 ' HB3' ' A' ' 191' ' ' GLU . 2.6 m -107.48 141.1 39.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.018 -0.537 . . . . 75.32 110.662 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.612 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 5.8 p90 -159.64 -177.7 6.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 73.43 111.177 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -138.71 141.86 38.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.899 -0.591 . . . . 72.33 110.552 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.574 HG21 HD21 ' A' ' 179' ' ' LEU . 23.5 t -121.55 152.43 25.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 70.42 112.01 -178.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -135.5 106.0 6.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.707 -0.679 . . . . 75.02 110.356 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.657 HD22 ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.67 126.79 30.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.362 -0.381 . . . . 73.43 110.658 -179.774 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.51 HG21 ' HE1' ' A' ' 134' ' ' TRP . 21.2 t -108.06 -30.25 2.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.263 -0.426 . . . . 71.13 111.654 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -169.96 160.05 8.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.915 0.388 . . . . 63.53 111.183 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.647 HG23 HG12 ' A' ' 131' ' ' VAL . 3.5 mp -141.85 111.27 2.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.971 -0.559 . . . . 61.21 110.955 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.327 -0.397 . . . . 64.44 110.958 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.629 ' HB3' HG21 ' A' ' 75' ' ' THR . 2.5 mpt? . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.849 0.357 . . . . 53.45 111.207 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.56 156.24 25.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.179 -0.464 . . . . 62.21 111.028 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.597 ' O ' ' HB2' ' A' ' 4' ' ' ALA . . . -60.84 -168.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.183 -0.462 . . . . 43.2 111.113 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.597 ' HB2' ' O ' ' A' ' 3' ' ' ALA . . . 161.73 87.21 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.135 -0.484 . . . . 73.35 110.948 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 1.021 HG11 HG21 ' A' ' 136' ' ' THR . 43.8 t -87.17 111.1 38.6 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.595 -0.275 . . . . 51.33 110.966 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.434 ' HG3' ' CG ' ' A' ' 32' ' ' HIS . 72.4 Cg_endo -77.62 136.99 15.89 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.638 2.226 . . . . 74.44 112.435 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 19.6 mm-40 -80.25 155.52 27.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 71.14 110.902 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.09 112.81 0.78 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.137 -0.483 . . . . 64.13 111.221 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.449 ' HB2' ' HE2' ' A' ' 187' ' ' LYS . . . -90.44 -14.78 32.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 71.43 111.414 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.595 ' CE2' HD11 ' A' ' 20' ' ' LEU . 1.3 m-90 -137.98 173.79 11.26 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.967 0.413 . . . . 74.3 110.814 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.2 m -115.43 149.83 37.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.988 -0.551 . . . . 63.43 110.713 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.678 HG11 ' HE2' ' A' ' 154' ' ' LYS . 21.9 t -56.09 -31.33 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.926 0.393 . . . . 73.12 110.712 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -76.02 -25.96 56.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.871 -0.604 . . . . 70.11 111.004 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -82.11 -57.92 3.18 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.834 0.349 . . . . 54.12 110.813 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.644 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.3 mt -49.57 -63.09 1.21 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.222 -0.445 . . . . 73.2 110.948 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.591 ' HD2' HG12 ' A' ' 12' ' ' VAL . 25.4 mtt180 -53.99 -23.79 14.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.071 -0.513 . . . . 74.51 111.243 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.18 176.76 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.964 0.412 . . . . 62.43 111.121 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -110.34 16.8 21.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.95 -0.568 . . . . 74.31 111.158 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.41 -26.09 12.09 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.512 -0.313 . . . . 71.31 111.144 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.699 HD22 HD11 ' A' ' 25' ' ' ILE . 6.3 tt -91.97 111.55 50.45 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.39 -0.368 . . . . 64.53 111.016 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.406 ' O ' HD23 ' A' ' 20' ' ' LEU . 48.2 Cg_exo -55.88 130.01 38.04 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.378 2.052 . . . . 51.14 112.184 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.42 ' O ' HD12 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -62.31 -24.09 67.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 75.23 111.127 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.5 mttt -49.78 -43.19 48.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.31 -0.404 . . . . 71.2 111.588 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -73.86 -54.79 7.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.936 0.398 . . . . 75.12 111.07 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.699 HD11 HD22 ' A' ' 20' ' ' LEU . 25.7 mt -45.36 -33.86 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.846 -0.615 . . . . 71.43 111.443 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.694 HG12 HD21 ' A' ' 59' ' ' LEU . 6.7 mt -76.79 -39.85 31.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.284 -0.416 . . . . 73.24 110.995 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.1 mttt -72.86 -25.61 61.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.036 -0.529 . . . . 61.15 111.009 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -69.74 -45.78 67.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.121 0.486 . . . . 74.14 110.719 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.723 HD21 ' HA ' ' A' ' 63' ' ' TYR . 2.6 mt -70.17 -25.58 63.51 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.608 -0.724 . . . . 62.14 111.115 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -74.38 -26.74 60.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.355 -0.384 . . . . 64.2 110.893 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.416 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 8.6 pt-20 -90.81 -39.05 12.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.346 -0.388 . . . . 73.23 110.706 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.434 ' CG ' ' HG3' ' A' ' 6' ' ' PRO . 35.8 m170 -98.54 16.63 21.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 64.1 110.964 179.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.61 153.32 23.02 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.829 -0.7 . . . . 62.42 112.571 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.57 154.47 19.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.651 0.263 . . . . 53.33 110.515 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.67 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.1 OUTLIER -49.14 -56.97 7.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.76 0.315 . . . . 74.42 111.1 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -48.18 -50.23 29.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.033 0.444 . . . . 54.42 110.896 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.545 ' CZ ' HD12 ' A' ' 66' ' ' LEU . 13.4 t80 -54.04 -47.73 71.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.795 -0.639 . . . . 72.11 110.493 179.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.441 ' HB3' ' N ' ' A' ' 44' ' ' LEU . 13.3 mt -66.02 -41.39 91.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.062 -0.517 . . . . 65.01 110.777 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.827 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -48.07 -42.04 27.67 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.076 0.465 . . . . 73.4 110.827 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -49.55 -50.11 43.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.621 -0.718 . . . . 74.4 110.926 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -101.49 15.3 29.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.076 -0.511 . . . . 63.21 111.291 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 36.1 mttt 54.98 39.92 31.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.884 0.373 . . . . 73.53 111.05 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 43' ' ' LEU . 17.0 mt -89.53 -22.18 22.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 72.41 111.487 -179.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.827 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.42 156.01 28.09 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.106 0.479 . . . . 74.23 111.171 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.72 -120.98 4.87 Favored Glycine 0 N--CA 1.451 -0.301 0 CA-C-N 115.641 -0.709 . . . . 74.12 112.379 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.897 ' O ' HG23 ' A' ' 50' ' ' VAL . 5.2 m120 -116.39 115.2 25.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.771 0.32 . . . . 53.42 110.948 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.531 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -45.18 -58.37 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.186 -0.461 . . . . 62.42 111.397 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 mmtt -45.57 -36.96 5.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.782 -0.644 . . . . 74.35 111.049 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -85.77 -26.54 25.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.939 -0.573 . . . . 71.53 110.993 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 46' ' ' ASN . 19.3 t -80.83 -26.03 10.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 71.12 111.417 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.64 -15.7 63.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.364 -0.38 . . . . 62.31 111.394 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.3 mtpt -95.17 -35.16 11.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.411 -0.359 . . . . 63.44 110.931 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 m -86.03 -22.42 27.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.173 -0.467 . . . . 61.44 111.318 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -107.95 136.76 47.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.467 -0.333 . . . . 35.33 111.19 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -93.27 -178.02 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 65.3 110.768 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.546 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -59.71 -58.1 10.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.825 0.345 . . . . 72.31 110.981 -179.758 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.32 -27.3 65.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.119 -0.491 . . . . 72.35 110.67 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -45.48 93.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.007 -0.542 . . . . 71.14 110.702 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.694 HD21 HG12 ' A' ' 26' ' ' ILE . 23.6 mt -73.31 -30.49 63.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.625 -0.716 . . . . 70.55 111.415 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.644 HG22 ' HB3' ' A' ' 15' ' ' LEU . 16.0 t -80.51 -43.67 21.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.989 0.424 . . . . 71.3 110.853 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.1 m -58.44 -35.87 72.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.881 -0.6 . . . . 71.43 110.583 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.71 -21.84 34.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.084 -0.507 . . . . 71.24 111.031 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.723 ' HA ' HD21 ' A' ' 29' ' ' LEU . 49.3 t80 -83.28 -22.96 32.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.298 -0.41 . . . . 73.22 111.162 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.476 ' ND2' HG12 ' A' ' 60' ' ' VAL . 19.8 m-80 -83.07 -54.03 5.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.885 0.374 . . . . 74.13 111.43 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.433 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 4.4 p-80 -61.16 -34.08 74.45 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.495 . . . . 63.03 111.283 -179.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.661 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.2 tt -46.42 -40.47 12.24 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.898 0.38 . . . . 73.11 111.201 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -78.98 -36.09 41.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.009 -0.541 . . . . 74.42 110.691 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.536 ' HG2' HG23 ' A' ' 69' ' ' THR . 2.2 pt-20 -67.25 -39.85 86.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.058 -0.519 . . . . 72.24 110.873 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.536 HG23 ' HG2' ' A' ' 68' ' ' GLU . 71.5 p -94.87 -3.1 49.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.025 -0.534 . . . . 33.34 111.434 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 48.96 39.66 15.1 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.757 0.313 . . . . 61.45 111.38 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -93.52 43.66 1.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.384 -0.371 . . . . 73.34 111.034 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.447 ' HA ' HD21 ' A' ' 66' ' ' LEU . 88.5 m-85 -66.26 177.09 1.54 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.317 -0.401 . . . . 61.4 110.82 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 43.2 tttt -66.57 153.06 43.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.262 -0.426 . . . . 74.53 110.985 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' A' ' 76' ' ' GLU . . . -133.32 74.98 0.43 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.77 -0.728 . . . . 74.24 112.529 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.629 HG21 ' HB3' ' A' ' 1' ' ' MET . 4.4 p 51.59 -87.77 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.612 0.244 . . . . 71.15 111.367 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.53 ' H ' ' HG1' ' A' ' 75' ' ' THR . 3.7 mt-10 63.39 143.23 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.82 0.343 . . . . 72.05 110.884 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.48 ' O ' HG23 ' A' ' 78' ' ' ILE . 1.6 t -66.58 113.14 4.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 45.44 110.897 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.743 HD12 ' N ' ' A' ' 79' ' ' SER . 2.5 pp -157.49 -44.98 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 54.22 111.208 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.743 ' N ' HD12 ' A' ' 78' ' ' ILE . 92.4 p -105.03 127.62 52.96 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.029 -0.532 . . . . 75.41 110.911 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.3 tttp -134.82 92.47 2.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 74.3 110.919 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.4 t -99.94 99.14 7.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 72.53 111.101 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 50.7 p -161.63 -44.66 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 71.42 110.886 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 66.5 -75.97 0.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.238 -0.437 . . . . 52.24 110.937 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 62.76 147.73 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.018 -0.537 . . . . 63.55 110.933 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.486 HG12 ' N ' ' A' ' 86' ' ' LYS . 21.3 t -109.31 159.0 9.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 61.11 111.164 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.492 ' O ' HG22 ' A' ' 88' ' ' VAL . 1.6 tttp -59.31 -172.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.272 -0.422 . . . . 64.32 110.95 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -61.18 95.29 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 70.43 110.919 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.492 HG22 ' O ' ' A' ' 86' ' ' LYS . 30.0 m -150.62 164.92 2.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 75.32 111.094 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.87 -36.94 11.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 74.35 110.865 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 12.8 mt 58.61 106.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.481 . . . . 71.34 110.956 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -97.23 77.59 2.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 65.31 110.842 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -175.42 160.72 2.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 73.22 110.869 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -94.44 120.65 34.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 71.4 110.876 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.8 mtpm? -112.27 150.15 42.09 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 73.33 110.885 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.1 177.85 5.38 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.533 2.155 . . . . 74.14 112.329 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.42 106.46 16.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.245 -0.434 . . . . 42.41 110.875 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -101.05 151.52 21.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 74.23 110.891 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.542 HG23 ' O ' ' A' ' 98' ' ' THR . 7.2 t -175.73 87.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 71.23 110.911 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 mmtm 62.5 -80.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.124 -0.489 . . . . 75.12 111.026 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.5 m -84.69 164.69 18.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.243 -0.435 . . . . 60.12 110.926 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -96.24 76.58 3.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.437 . . . . 74.21 110.951 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 60.08 109.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 71.25 110.891 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 10.0 p -123.93 101.08 7.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 73.33 110.889 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.465 HD12 HG23 ' A' ' 112' ' ' THR . 10.0 mt 60.4 93.13 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.465 . . . . 73.0 110.926 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -106.93 -29.76 9.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 73.33 110.919 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -58.84 -31.13 68.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 60.22 110.951 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 112.75 95.04 2.18 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.735 -0.745 . . . . 75.21 112.523 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -68.1 157.7 60.68 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.502 2.134 . . . . 73.34 112.304 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -49.36 -71.84 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.564 2.176 . . . . 61.13 112.496 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.444 ' HB3' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -163.86 23.68 0.07 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.461 . . . . 70.02 110.687 179.746 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -166.53 150.52 7.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 74.14 110.858 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.465 HG23 HD12 ' A' ' 104' ' ' LEU . 77.0 m -112.23 133.02 54.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.126 -0.488 . . . . 75.32 110.346 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.402 ' CE ' HG22 ' A' ' 115' ' ' VAL . 1.0 OUTLIER -130.88 148.32 52.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.953 0.406 . . . . 64.11 111.33 -179.607 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -149.6 121.75 8.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.934 -0.576 . . . . 53.21 110.742 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.402 HG22 ' CE ' ' A' ' 113' ' ' LYS . 21.5 t -78.86 110.24 14.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.326 -0.397 . . . . 75.22 111.224 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.526 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -81.69 -46.62 14.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 64.03 110.926 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -124.32 108.12 11.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.438 . . . . 74.34 111.054 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.6 ttpm? -59.57 141.89 53.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 74.41 110.865 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.504 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -112.86 -156.11 12.35 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.738 -0.744 . . . . 71.21 112.605 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -36.05 -51.72 0.74 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.96 0.409 . . . . 64.52 111.527 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 69.03 33.82 3.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.926 -0.579 . . . . 63.1 110.307 -179.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 54.8 m -152.4 -44.61 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.76 -0.655 . . . . 60.43 110.698 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -88.94 91.13 8.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.481 . . . . 62.13 110.732 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -99.5 152.72 37.9 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 74.15 110.826 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.57 ' HB2' HG21 ' A' ' 166' ' ' VAL . 61.2 Cg_endo -72.96 125.5 10.46 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.551 2.167 . . . . 72.24 112.495 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 1.4 mmtm -96.36 154.13 17.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.982 -0.554 . . . . 63.23 110.865 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.0 tptm -56.75 119.67 6.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.24 -0.437 . . . . 52.44 110.795 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 100.24 -22.72 38.81 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.626 -0.797 . . . . 72.44 112.366 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.708 ' O ' HG22 ' A' ' 166' ' ' VAL . 5.0 m-20 -81.54 137.63 35.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.745 0.307 . . . . 70.24 110.69 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.57 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 15.6 m -75.09 175.41 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.198 0.523 . . . . 65.43 111.767 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.685 HG12 HG23 ' A' ' 223' ' ' ILE . 22.3 m -157.75 147.0 9.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.342 -0.845 . . . . 74.13 110.557 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.453 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -125.21 117.27 23.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.701 0.286 . . . . 74.41 110.633 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.456 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 32.1 p -154.2 167.25 30.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.87 0.367 . . . . 74.33 111.156 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.602 ' HB3' HD11 ' A' ' 149' ' ' ILE . 62.6 m95 -99.66 160.6 14.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.972 -0.558 . . . . 64.25 110.065 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 33.4 p90 -158.76 135.18 9.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.065 0.459 . . . . 75.23 111.584 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 1.021 HG21 HG11 ' A' ' 5' ' ' VAL . 54.3 m -126.74 111.59 14.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.658 -0.701 . . . . 64.24 110.417 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.577 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.78 142.9 16.35 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.604 -0.808 . . . . 75.31 113.07 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.69 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.1 OUTLIER -149.34 138.95 21.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.761 0.315 . . . . 73.1 110.799 179.764 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.831 HD11 HG12 ' A' ' 208' ' ' ILE . 32.6 mt -72.81 -178.14 2.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.296 -0.411 . . . . 63.15 110.64 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -58.89 -42.59 89.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.987 0.422 . . . . 73.34 110.796 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.27 -7.67 55.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.942 -0.572 . . . . 72.44 111.368 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . 0.423 ' HA2' ' HB2' ' A' ' 3' ' ' ALA . . . 94.7 25.77 14.61 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.648 -0.787 . . . . 63.02 112.582 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.27 108.38 18.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.8 0.333 . . . . 73.44 110.837 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 144' ' ' VAL . 11.2 p -66.31 124.01 20.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.18 -0.463 . . . . 75.53 111.116 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.434 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 44.8 p90 -110.08 -21.28 12.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.155 -0.475 . . . . 71.4 111.095 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -157.02 127.94 6.73 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.857 0.361 . . . . 74.22 110.997 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 75.1 m -142.79 105.28 4.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 54.1 110.862 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -76.07 -6.52 51.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 73.42 111.323 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.716 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.4 mp -95.78 114.76 33.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.827 0.346 . . . . 63.42 111.0 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -116.65 -73.94 0.63 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 71.41 110.908 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 61.4 p -113.15 165.96 11.89 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 60.54 110.909 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.3 m -95.12 168.53 10.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 51.23 110.895 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.04 -31.2 34.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.455 . . . . 63.42 111.093 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.678 ' HE2' HG11 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -60.05 -31.73 70.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 54.14 110.949 -179.965 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -78.36 -39.18 40.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 74.14 110.928 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 4.5 tttp -178.33 -177.63 0.58 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.097 -0.501 . . . . 53.13 110.919 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 9.5 mmtt -98.97 34.73 2.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 73.11 110.872 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 45.4 m-20 -100.59 36.75 1.84 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 73.12 110.933 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -155.6 126.46 6.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 60.53 111.131 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.2 tttt -146.64 145.41 23.09 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 54.43 110.676 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.65 158.02 58.01 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.355 2.037 . . . . 73.33 112.239 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -80.04 127.87 32.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.126 -0.488 . . . . 72.12 110.845 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.612 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.8 OUTLIER -105.73 126.83 52.62 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.272 -0.422 . . . . 74.11 111.047 179.801 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.701 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 20.8 p90 -151.35 141.45 22.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 72.33 110.951 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.605 ' CB ' HG21 ' A' ' 168' ' ' VAL . 2.4 mtpt -69.62 130.81 43.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.305 -0.407 . . . . 71.33 110.909 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.708 HG22 ' O ' ' A' ' 129' ' ' ASP . 33.3 m -87.77 149.32 4.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 63.33 111.057 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 69.04 24.22 75.9 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.729 -0.748 . . . . 74.21 112.577 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.605 HG21 ' CB ' ' A' ' 165' ' ' LYS . 15.4 m -134.09 46.43 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.915 0.388 . . . . 73.1 111.125 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.29 36.24 2.92 Favored Glycine 0 C--N 1.331 0.302 0 CA-C-N 116.101 -0.499 . . . . 50.4 113.295 179.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . 0.513 ' HG2' HG23 ' A' ' 168' ' ' VAL . 0.3 OUTLIER -82.43 -45.72 14.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.858 0.361 . . . . 74.42 111.089 -179.867 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -119.26 -179.64 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.087 -0.506 . . . . 74.4 110.994 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.557 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -58.35 159.33 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.394 -0.367 . . . . 72.1 111.136 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 7.4 ttt85 -68.04 -27.23 66.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.254 -0.43 . . . . 73.13 111.191 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.3 -36.34 39.91 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.663 -0.78 . . . . 51.02 112.169 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.765 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.2 t90 -78.28 -33.62 49.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.909 0.385 . . . . 72.15 111.109 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -64.42 -38.26 90.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.088 -0.506 . . . . 55.2 110.489 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -73.5 -30.62 63.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.901 -0.59 . . . . 73.02 110.619 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.605 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -79.74 -55.96 4.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.496 . . . . 65.51 111.106 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.701 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 5.3 mt -59.69 -28.78 67.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.933 -0.576 . . . . 74.54 110.809 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.4 mt -60.42 -32.02 70.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.425 . . . . 64.03 110.789 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 63.9 p -92.41 2.45 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 65.03 111.407 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.402 ' HB3' HD12 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -76.24 150.04 37.09 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.741 0.305 . . . . 65.24 110.769 179.916 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.4 165.38 13.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 63.24 111.206 -179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . 0.69 ' HA ' HD22 ' A' ' 220' ' ' LEU . 1.0 OUTLIER -60.49 117.62 5.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.951 -0.568 . . . . 72.52 110.8 179.807 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.53 66.41 2.25 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.675 -0.774 . . . . 71.24 112.319 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . 0.504 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 23.8 tt0 -144.51 145.81 32.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.602 0.239 . . . . 73.12 110.389 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . 0.449 ' HE2' ' HB2' ' A' ' 9' ' ' ALA . 0.5 OUTLIER -117.55 134.72 54.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.688 0.28 . . . . 74.12 110.332 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.29 168.0 20.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.113 0.482 . . . . 61.23 111.648 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.56 104.43 5.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.64 -0.709 . . . . 70.43 109.882 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.687 HD12 HD11 ' A' ' 192' ' ' ILE . 0.4 OUTLIER -126.52 147.18 49.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.081 0.467 . . . . 45.13 111.832 -179.069 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.843 ' HG3' HG23 ' A' ' 215' ' ' THR . 1.3 mp0 -117.07 125.17 50.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.689 -0.687 . . . . 72.43 110.438 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.687 HD11 HD12 ' A' ' 190' ' ' LEU . 2.4 mm -94.32 152.15 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.881 0.372 . . . . 74.32 111.221 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -87.06 159.11 51.95 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.052 -0.522 . . . . 70.12 110.657 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.37 -44.36 38.74 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.567 2.178 . . . . 55.12 112.228 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -56.34 -39.65 73.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.268 -0.424 . . . . 74.5 111.194 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.444 ' CD2' ' HB3' ' A' ' 110' ' ' LYS . 9.9 m0 -97.37 36.95 1.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.324 -0.398 . . . . 70.11 110.99 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -164.64 -77.52 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.025 -0.534 . . . . 53.33 110.705 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . 0.785 ' CE2' HD11 ' A' ' 214' ' ' LEU . 22.3 m-85 -102.85 -71.22 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 71.14 110.571 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 135.32 175.87 14.06 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.839 -0.696 . . . . 62.52 112.714 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 19.8 mtpt -58.34 -32.38 68.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.879 0.371 . . . . 74.44 110.884 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 11.1 mttm -59.83 -52.95 63.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 62.12 110.729 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 103.58 176.11 26.04 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.822 -0.704 . . . . 45.2 112.499 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.431 ' HG3' ' CE1' ' A' ' 198' ' ' TYR . 0.4 OUTLIER -117.3 81.75 13.86 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.822 0.344 . . . . 75.11 110.791 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.12 -25.26 44.74 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.669 2.246 . . . . 64.45 112.46 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.25 -42.19 94.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.917 0.389 . . . . 64.12 111.04 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -103.82 29.81 5.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.114 -0.494 . . . . 73.25 111.212 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 39.8 mttt 56.09 28.03 12.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.258 -0.428 . . . . 73.2 111.075 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.831 HG12 HD11 ' A' ' 139' ' ' LEU . 40.0 mt -91.38 111.67 50.15 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 73.43 110.992 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -74.0 173.92 13.25 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.491 2.127 . . . . 72.32 112.474 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -51.04 137.91 44.2 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.674 2.249 . . . . 72.24 112.255 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 5.9 p30 42.11 88.81 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.151 -0.477 . . . . 71.25 111.395 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -125.47 116.27 21.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.319 -0.4 . . . . 55.54 111.398 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 1.6 tptm -65.66 126.58 28.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 64.2 110.378 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.785 HD11 ' CE2' ' A' ' 198' ' ' TYR . 19.1 mt -104.47 109.52 21.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.342 -0.39 . . . . 72.15 111.44 -179.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.843 HG23 ' HG3' ' A' ' 191' ' ' GLU . 52.4 m -102.45 137.31 40.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 70.24 110.563 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.577 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 5.5 p90 -154.94 175.26 14.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.027 0.442 . . . . 75.25 111.331 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -133.01 136.77 46.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.645 . . . . 73.43 110.523 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.765 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.1 t -123.63 150.56 27.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.072 0.463 . . . . 64.32 111.891 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -136.81 111.07 8.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.744 -0.662 . . . . 74.4 110.225 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.74 HD21 HG13 ' A' ' 223' ' ' ILE . 1.9 tt -69.93 129.28 39.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.831 0.348 . . . . 52.54 111.004 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 21.6 t -108.7 -29.32 2.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 64.54 111.421 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . 0.426 ' N ' HD23 ' A' ' 220' ' ' LEU . 5.7 t70 -170.66 161.34 7.49 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.91 0.386 . . . . 53.11 111.018 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.74 HG13 HD21 ' A' ' 220' ' ' LEU . 46.6 mt -139.79 110.43 4.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 74.15 111.051 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . 0.405 ' C ' HG22 ' A' ' 130' ' ' VAL . 27.0 t70 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 74.54 110.952 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 ttp . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.83 0.348 . . . . 73.3 111.228 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.9 143.29 49.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 72.5 111.102 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.98 127.44 11.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.228 -0.442 . . . . 70.22 111.136 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.485 ' HB2' ' HB ' ' A' ' 215' ' ' THR . . . -88.22 174.45 8.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 54.23 111.077 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.94 HG11 HG21 ' A' ' 136' ' ' THR . 43.0 t -60.09 110.37 2.78 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 54.24 111.055 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.43 ' HD2' ' CE2' ' A' ' 72' ' ' PHE . 95.1 Cg_endo -78.72 143.84 19.05 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.667 2.244 . . . . 75.54 112.408 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -81.67 151.34 27.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 64.35 110.774 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.57 113.99 0.95 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 74.23 111.182 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -88.07 -16.34 33.84 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.14 -0.482 . . . . 55.22 111.351 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.414 ' CH2' ' HB3' ' A' ' 24' ' ' ASP . 3.9 m-90 -136.34 173.63 11.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.836 0.35 . . . . 63.31 110.719 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.1 m -115.82 150.33 37.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.069 -0.514 . . . . 72.52 110.617 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.626 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.9 t -56.3 -32.06 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.958 0.409 . . . . 71.14 110.772 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -77.01 -24.66 52.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.926 -0.579 . . . . 60.22 111.156 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.421 ' O ' ' HB2' ' A' ' 17' ' ' SER . 3.4 tt0 -82.12 -57.25 3.48 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.851 0.358 . . . . 74.34 110.911 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.631 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.2 mt -51.3 -60.31 3.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.253 -0.43 . . . . 74.24 111.012 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.626 ' HD2' HG12 ' A' ' 12' ' ' VAL . 21.7 mtt180 -57.51 -25.43 59.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.031 -0.531 . . . . 72.53 111.33 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.421 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -59.02 173.06 0.49 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.847 0.356 . . . . 72.32 110.983 -179.867 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -99.78 16.18 24.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.095 -0.502 . . . . 74.12 111.207 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -112.31 -30.35 7.21 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.421 -0.354 . . . . 73.34 110.805 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.924 HD12 HD11 ' A' ' 25' ' ' ILE . 2.4 tm? -75.26 114.27 33.78 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 44.33 110.673 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.681 ' HD2' HD22 ' A' ' 20' ' ' LEU . 34.4 Cg_endo -64.91 123.3 11.42 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.389 2.059 . . . . 71.1 112.488 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.404 ' HB2' ' CD1' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -62.75 -26.52 68.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.04 -0.527 . . . . 75.23 111.254 -179.912 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.483 ' HA ' HD12 ' A' ' 26' ' ' ILE . 4.2 ttmt -53.54 -37.02 62.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.877 0.37 . . . . 73.42 111.174 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.414 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 0.1 OUTLIER -74.41 -56.1 5.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 72.2 110.845 179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.924 HD11 HD12 ' A' ' 20' ' ' LEU . 42.5 mt -44.89 -32.09 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.83 -0.623 . . . . 72.54 111.44 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.642 ' HB ' HG23 ' A' ' 47' ' ' ILE . 7.6 mt -76.66 -40.68 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 60.03 111.038 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -71.42 -24.91 62.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.893 -0.594 . . . . 73.14 111.21 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -72.36 -45.5 59.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.949 0.404 . . . . 75.42 110.886 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.785 HD21 ' HA ' ' A' ' 63' ' ' TYR . 3.6 mt -68.41 -25.09 64.86 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.859 -0.609 . . . . 73.24 111.053 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -80.95 -24.44 38.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.31 -0.404 . . . . 70.5 111.177 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.42 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -101.26 -7.35 23.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.469 -0.332 . . . . 74.13 111.503 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.42 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.9 m-70 -125.78 -3.13 7.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.7 -0.227 . . . . 73.45 111.606 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.43 161.37 19.91 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.707 -0.758 . . . . 54.33 112.418 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -89.68 149.45 22.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.588 0.233 . . . . 62.42 110.61 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.657 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -49.1 -57.0 7.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.801 0.334 . . . . 73.21 111.075 -179.798 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 14.5 m -47.24 -51.61 18.29 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.217 -0.447 . . . . 71.43 110.852 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.49 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 12.8 t80 -55.19 -44.3 75.19 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.857 -0.61 . . . . 54.53 110.323 179.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.583 HD12 ' HA ' ' A' ' 35' ' ' ASP . 13.4 mt -65.38 -42.4 92.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.015 -0.539 . . . . 73.43 110.665 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.819 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -46.48 -45.35 18.28 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.223 -0.444 . . . . 73.11 111.171 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.28 -25.74 64.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.857 -0.611 . . . . 71.04 110.859 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 67.0 m-70 -112.69 8.49 19.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.253 -0.43 . . . . 74.33 111.166 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt 54.38 33.7 19.14 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.804 0.335 . . . . 74.11 110.905 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.735 HD13 HD13 ' A' ' 29' ' ' LEU . 61.8 mt -92.39 -24.9 18.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 51.54 111.758 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.819 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -73.79 156.66 37.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.092 0.472 . . . . 72.14 111.185 -179.568 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.4 -122.75 5.7 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.671 -0.695 . . . . 61.43 112.378 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.789 ' O ' HG23 ' A' ' 50' ' ' VAL . 4.1 m120 -116.31 119.48 35.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.787 0.327 . . . . 64.03 110.93 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.642 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -45.96 -53.22 2.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.224 -0.444 . . . . 74.35 111.337 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -47.93 -38.2 16.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.887 -0.597 . . . . 54.11 110.961 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -85.61 -25.57 26.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 74.22 111.059 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.789 HG23 ' O ' ' A' ' 46' ' ' ASN . 26.3 t -81.86 -25.83 9.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.343 -0.389 . . . . 62.44 111.396 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.97 -17.13 63.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.384 -0.371 . . . . 73.55 111.438 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.2 pttt -95.19 -35.37 11.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.445 -0.343 . . . . 70.24 110.941 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.4 m -86.2 -23.38 26.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.202 -0.453 . . . . 72.04 111.105 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -101.97 125.9 48.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.373 -0.376 . . . . 74.23 111.161 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.29 175.28 10.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 53.52 110.559 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.684 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -58.1 -58.28 9.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.823 0.344 . . . . 74.12 110.51 179.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.86 -26.08 68.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.109 -0.496 . . . . 74.33 110.578 179.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.48 -43.21 99.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.114 -0.494 . . . . 72.33 110.341 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.619 HD21 HG12 ' A' ' 26' ' ' ILE . 20.8 mt -75.04 -30.11 60.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.631 -0.713 . . . . 65.32 110.998 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 56' ' ' LYS . 14.0 t -79.14 -43.14 24.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.984 0.421 . . . . 65.44 110.759 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.9 m -60.27 -36.21 77.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.823 -0.626 . . . . 72.44 110.707 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.481 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -80.85 -22.31 40.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 75.22 111.0 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.785 ' HA ' HD21 ' A' ' 29' ' ' LEU . 14.2 t80 -83.76 -22.89 31.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.117 -0.492 . . . . 70.25 110.956 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.441 ' ND2' HG12 ' A' ' 60' ' ' VAL . 72.5 m-20 -84.99 -54.35 4.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 75.34 111.342 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.466 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 2.5 p-80 -61.39 -24.49 66.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.06 -0.518 . . . . 75.45 111.179 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.766 HD12 HD23 ' A' ' 29' ' ' LEU . 3.9 tt -55.39 -39.33 70.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.937 0.399 . . . . 53.11 110.835 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -78.25 -38.82 41.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.025 -0.534 . . . . 71.33 110.705 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -37.46 78.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.013 -0.54 . . . . 62.03 111.002 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 45.4 p -90.02 -9.53 48.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.079 -0.509 . . . . 51.1 111.489 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.478 ' HD3' HG11 ' A' ' 144' ' ' VAL . 0.1 OUTLIER 52.25 34.1 13.96 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.764 0.316 . . . . 75.54 111.186 179.833 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 42.5 mtt180 -93.63 45.18 1.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.289 -0.414 . . . . 72.44 111.048 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.599 ' CE2' HD22 ' A' ' 66' ' ' LEU . 89.9 m-85 -69.0 178.73 2.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.43 . . . . 72.51 110.824 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 46.3 tttt -70.77 153.01 43.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.229 -0.441 . . . . 62.12 110.872 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 176.2 -159.95 27.48 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.7 -0.762 . . . . 72.41 112.532 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 68.9 p -60.24 143.0 53.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.831 0.348 . . . . 64.43 110.928 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -177.45 -39.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 75.43 110.934 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.659 ' C ' HD12 ' A' ' 78' ' ' ILE . 4.2 m -106.46 -34.43 7.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.069 -0.514 . . . . 74.45 110.88 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.659 HD12 ' C ' ' A' ' 77' ' ' SER . 3.9 mp 60.07 158.71 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 73.41 111.121 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.479 ' N ' HG22 ' A' ' 78' ' ' ILE . 0.6 OUTLIER -81.02 96.58 7.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.465 . . . . 74.12 110.929 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.528 ' O ' HG13 ' A' ' 81' ' ' VAL . 34.3 mttt -75.25 157.58 34.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.448 . . . . 75.22 110.908 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.528 HG13 ' O ' ' A' ' 80' ' ' LYS . 7.5 m -158.7 -44.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 44.44 111.173 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.4 m 61.65 103.26 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.042 -0.526 . . . . 73.03 110.924 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -152.3 137.5 17.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 74.32 110.885 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.715 ' O ' HG13 ' A' ' 85' ' ' VAL . 6.3 mm-40 -77.3 151.77 34.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 63.21 110.972 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.715 HG13 ' O ' ' A' ' 84' ' ' GLN . 0.2 OUTLIER -167.54 -42.86 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.928 -0.578 . . . . 65.44 111.085 -179.794 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -166.35 146.62 6.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.996 -0.547 . . . . 71.55 110.898 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -78.05 91.79 4.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 72.14 110.891 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 14.5 m -143.37 141.1 26.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.212 -0.449 . . . . 73.3 111.106 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.83 -32.84 7.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.215 -0.448 . . . . 75.23 110.876 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -87.79 144.17 26.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 72.41 110.923 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -169.21 111.17 0.49 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 65.32 110.918 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -107.82 -32.9 7.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 61.44 110.878 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -154.24 115.97 4.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 74.1 110.901 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.64 87.42 0.95 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 62.14 110.914 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.8 106.58 1.69 Allowed 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.535 2.157 . . . . 72.25 112.335 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 7.2 mmmt -110.39 -32.85 6.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 72.31 110.915 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -120.66 151.76 39.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.446 . . . . 65.41 110.91 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 40.4 p -135.63 109.45 8.11 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 71.45 110.925 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.7 mmtp -107.36 -32.94 7.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 64.24 110.896 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -113.44 130.11 56.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 74.51 110.907 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -160.56 87.72 0.76 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 64.0 110.874 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -151.97 117.21 5.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 65.21 110.943 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.574 HG22 ' O ' ' A' ' 103' ' ' THR . 27.8 m -140.6 32.48 1.84 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.169 -0.468 . . . . 65.51 110.945 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.7 mt 60.32 103.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 35.43 110.861 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -84.5 -31.35 24.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.27 -0.423 . . . . 55.23 110.981 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -125.71 88.08 2.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 74.33 110.9 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -163.29 128.42 1.84 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.731 -0.747 . . . . 42.55 112.456 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.513 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 32.0 Cg_exo -56.7 -45.97 33.0 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.401 2.067 . . . . 73.53 112.881 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.513 ' CD ' ' N ' ' A' ' 108' ' ' PRO . 91.5 Cg_endo -82.18 -172.54 1.47 Allowed 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 123.051 2.5 . . . . 62.43 112.435 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.433 ' HE2' ' CD1' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -132.56 29.31 4.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 70.4 110.967 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 19.1 p90 -130.88 151.06 51.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 72.44 110.819 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 4.8 m -120.27 128.7 53.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.272 -0.422 . . . . 74.12 110.683 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -124.66 144.25 50.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.338 -0.392 . . . . 71.21 111.0 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.1 t -145.36 117.18 8.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 62.43 110.909 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 24.1 t -74.78 107.31 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 74.4 111.147 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.415 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.9 mm? -77.45 -53.93 7.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 72.42 111.005 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -120.68 108.19 13.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 73.44 111.096 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.75 149.63 21.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 74.11 110.87 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.522 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -121.88 -155.04 9.32 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.637 -0.792 . . . . 71.31 112.662 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -37.93 -53.4 1.34 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.964 0.411 . . . . 73.23 111.436 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.65 36.04 1.32 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.87 -0.604 . . . . 75.31 110.18 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 24.2 m -153.53 -44.09 0.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.645 -0.707 . . . . 70.41 110.663 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -92.82 96.71 10.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 62.54 110.819 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -108.76 151.27 41.67 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 73.32 110.893 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.693 ' HB3' HG11 ' A' ' 166' ' ' VAL . 52.9 Cg_exo -55.04 125.59 19.7 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.517 2.145 . . . . 51.24 112.36 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -101.91 145.55 29.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.098 -0.501 . . . . 74.52 110.9 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -55.21 113.32 1.34 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.255 -0.429 . . . . 63.4 110.95 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.23 -19.61 48.05 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.644 -0.789 . . . . 72.01 112.577 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.59 138.22 31.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.8 0.333 . . . . 75.44 110.823 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.6 HG12 ' HG3' ' A' ' 165' ' ' LYS . 20.8 m -68.58 172.1 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.05 0.452 . . . . 73.25 111.415 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.899 HG22 ' O ' ' A' ' 164' ' ' PHE . 19.5 m -156.75 144.36 10.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.612 -0.722 . . . . 74.43 110.19 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.481 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.76 117.85 22.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.759 0.314 . . . . 71.24 110.99 -179.85 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.459 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 27.0 p -154.76 168.82 25.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.36 -0.382 . . . . 72.13 111.093 -179.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.564 ' O ' HG13 ' A' ' 218' ' ' VAL . 75.5 m95 -102.18 161.58 13.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.057 -0.52 . . . . 64.43 110.129 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.504 ' OH ' HD13 ' A' ' 162' ' ' LEU . 14.1 p90 -159.27 135.05 8.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.042 0.449 . . . . 72.21 111.65 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.94 HG21 HG11 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -127.45 112.92 15.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.792 -0.64 . . . . 71.55 110.394 179.65 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.558 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.94 144.88 17.6 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.564 -0.827 . . . . 64.01 113.137 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.727 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -151.25 140.64 21.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.725 0.298 . . . . 65.15 110.473 179.695 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.43 HD21 HG23 ' A' ' 208' ' ' ILE . 99.2 mt -78.09 -178.04 5.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.325 -0.398 . . . . 72.51 111.173 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -59.04 -42.89 91.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.969 -0.559 . . . . 74.13 110.857 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.31 -4.68 37.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.976 -0.556 . . . . 74.43 111.413 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . 0.498 ' C ' HG22 ' A' ' 138' ' ' THR . . . 89.47 22.0 38.8 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.687 -0.768 . . . . 74.31 112.696 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.85 108.31 19.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.859 0.362 . . . . 73.5 110.683 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.672 ' CG1' HG23 ' A' ' 138' ' ' THR . 3.5 m -68.33 130.33 33.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 64.43 111.247 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.499 ' HB3' HD11 ' A' ' 208' ' ' ILE . 34.8 p90 -110.95 -31.04 7.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 62.21 110.919 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -140.23 124.8 18.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 74.43 110.983 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.843 HG23 HG23 ' A' ' 136' ' ' THR . 29.4 m -142.59 102.86 4.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 61.23 110.736 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 45.3 t30 -76.15 -6.27 50.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 73.11 111.387 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.688 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.6 mp -95.54 115.98 35.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.844 0.354 . . . . 63.13 111.036 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.56 -74.73 0.64 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.153 -0.476 . . . . 74.13 110.903 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 72.3 p -142.18 166.01 25.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.27 -0.423 . . . . 73.53 110.893 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 14.7 m -82.72 170.2 15.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 41.14 110.927 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -80.96 -27.42 36.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 52.21 111.172 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.05 -31.89 65.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.31 -0.405 . . . . 70.43 111.043 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 20.2 tttp -89.63 -33.82 16.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.445 . . . . 60.44 110.857 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -177.17 138.27 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 72.45 110.857 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.49 77.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 75.12 110.843 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -142.27 47.62 1.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 74.33 110.835 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -140.23 120.79 14.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.459 . . . . 53.05 111.083 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 17.9 mttt -146.42 109.16 4.19 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 73.33 110.917 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.404 ' HB2' ' HB3' ' A' ' 132' ' ' HIS . 77.2 Cg_exo -50.63 150.37 12.18 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.442 2.095 . . . . 64.31 112.327 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.504 HD13 ' OH ' ' A' ' 135' ' ' TYR . 3.7 tt -74.21 119.28 18.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 60.24 110.631 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.703 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.45 122.1 42.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.885 0.374 . . . . 72.12 111.237 -179.813 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.899 ' O ' HG22 ' A' ' 131' ' ' VAL . 6.8 p90 -151.52 143.1 23.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 74.43 110.874 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.6 ' HG3' HG12 ' A' ' 130' ' ' VAL . 64.3 mttt -78.0 138.28 38.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.037 0.446 . . . . 60.54 111.151 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.693 HG11 ' HB3' ' A' ' 125' ' ' PRO . 28.6 m -87.78 149.11 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.831 -0.622 . . . . 74.11 111.133 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.03 22.57 78.48 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.858 -0.687 . . . . 60.33 112.737 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.561 HG22 ' O ' ' A' ' 165' ' ' LYS . 17.9 m -128.55 42.87 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.846 0.355 . . . . 52.44 111.172 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 40.48 38.19 1.39 Allowed Glycine 0 C--N 1.333 0.391 0 CA-C-N 116.013 -0.54 . . . . 74.31 113.461 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.64 -47.1 10.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.862 0.363 . . . . 74.41 111.131 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.9 m -112.04 -179.9 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.072 -0.513 . . . . 71.22 111.079 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.549 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -60.54 160.62 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.303 -0.408 . . . . 72.25 111.377 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . 0.405 ' HA ' ' OD2' ' A' ' 176' ' ' ASP . 27.6 ttt180 -67.72 -25.83 65.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.1 -0.5 . . . . 75.35 111.285 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -80.31 -33.69 31.33 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.63 -0.795 . . . . 60.13 112.399 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.783 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.5 t90 -80.8 -35.69 32.68 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.071 0.397 . . . . 70.11 112.071 -179.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . 0.405 ' OD2' ' HA ' ' A' ' 173' ' ' ARG . 7.0 p30 -73.04 -31.35 64.37 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.794 0.33 . . . . 44.3 110.277 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -74.59 -30.65 61.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 72.11 110.18 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.473 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -88.0 -45.25 10.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.012 -0.54 . . . . 52.22 111.132 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.62 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 4.8 mt -57.68 -38.7 75.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.13 -0.486 . . . . 72.03 110.607 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 16.5 mt -55.4 -24.19 28.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.124 -0.489 . . . . 73.12 110.937 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.0 -3.99 56.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.227 -0.442 . . . . 54.24 111.417 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.55 154.09 27.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.776 0.322 . . . . 61.54 110.623 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -120.08 171.52 8.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.977 0.418 . . . . 53.41 111.447 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . 0.61 ' HA ' HD22 ' A' ' 220' ' ' LEU . 24.7 tttt -64.72 120.73 13.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.788 -0.642 . . . . 63.23 110.506 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 67.85 63.8 3.49 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.543 -0.837 . . . . 64.35 112.19 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . 0.522 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 22.3 tt0 -144.57 147.03 32.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.633 0.254 . . . . 74.25 110.403 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -119.42 136.53 54.26 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.271 -0.27 . . . . 71.23 110.271 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -140.28 168.53 19.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.105 0.479 . . . . 53.55 111.811 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.66 101.01 4.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.589 -0.732 . . . . 74.31 109.874 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.673 HD23 ' H ' ' A' ' 190' ' ' LEU . 2.2 pt? -118.92 145.33 45.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.069 0.462 . . . . 75.41 111.884 -178.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.722 ' HB3' HG23 ' A' ' 215' ' ' THR . 16.2 pt-20 -118.14 116.21 26.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.625 -0.716 . . . . 74.23 110.248 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . . . . . . . . . 25.5 mt -106.89 128.7 61.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.279 -0.419 . . . . 64.44 111.589 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -61.65 164.9 8.42 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.902 -0.59 . . . . 74.22 110.615 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . 0.439 ' HG3' ' HA ' ' A' ' 211' ' ' ASN . 19.6 Cg_endo -58.68 -40.04 76.92 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.591 2.194 . . . . 64.31 112.291 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -53.54 -28.27 30.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 64.04 111.302 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.433 ' CD1' ' HE2' ' A' ' 110' ' ' LYS . 13.8 m0 -110.24 35.3 3.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.845 0.355 . . . . 74.15 111.091 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . 0.433 ' CB ' HD12 ' A' ' 214' ' ' LEU . . . -153.74 -79.93 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 74.23 111.071 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -108.37 -33.69 7.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.405 . . . . 72.13 110.771 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 111.36 177.7 20.32 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.827 -0.701 . . . . 60.55 112.652 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -59.22 -36.32 75.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 70.21 110.838 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.13 -53.15 61.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 62.42 110.653 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 119.95 -151.81 17.25 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.943 -0.646 . . . . 73.12 112.494 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.4 ' CB ' ' HB ' ' A' ' 208' ' ' ILE . 0.6 OUTLIER -143.98 78.14 14.16 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.905 0.383 . . . . 72.53 110.579 179.929 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -55.65 -21.7 32.79 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.599 2.2 . . . . 72.14 112.381 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.52 -42.12 99.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.419 -0.355 . . . . 74.52 110.955 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -111.9 22.68 14.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.188 -0.46 . . . . 65.52 111.356 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 21.5 mttp 58.52 54.46 5.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.916 0.389 . . . . 73.0 111.057 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.499 HD11 ' HB3' ' A' ' 145' ' ' PHE . 23.0 mm -108.81 111.81 60.67 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 72.01 111.017 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.75 163.2 3.04 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.475 2.117 . . . . 73.32 112.447 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.04 128.72 13.37 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.634 2.222 . . . . 71.44 112.338 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . 0.439 ' HA ' ' HG3' ' A' ' 194' ' ' PRO . 22.8 m-80 62.6 66.99 0.73 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.249 -0.432 . . . . 73.2 110.908 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.87 129.74 51.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.264 -0.425 . . . . 74.44 111.539 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . 0.514 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.0 OUTLIER -65.4 143.95 57.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.942 -0.572 . . . . 74.03 110.469 179.718 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.514 HD23 ' O ' ' A' ' 213' ' ' LYS . 9.6 mt -126.94 109.58 12.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.94 0.4 . . . . 63.55 111.779 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.722 HG23 ' HB3' ' A' ' 191' ' ' GLU . 2.7 m -107.67 138.05 44.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.974 -0.557 . . . . 75.21 110.436 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.558 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 22.7 p90 -152.41 175.31 12.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.094 0.473 . . . . 73.1 111.542 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -130.28 134.1 46.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.734 -0.666 . . . . 64.33 110.432 179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.783 HG21 ' HE1' ' A' ' 175' ' ' TRP . 5.8 t -121.73 150.43 25.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.997 0.427 . . . . 74.31 111.898 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -136.94 109.22 7.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.762 -0.654 . . . . 75.13 110.233 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.698 HD21 ' CG1' ' A' ' 223' ' ' ILE . 1.9 tt -70.06 133.25 47.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.504 -0.316 . . . . 63.43 110.975 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.402 ' N ' HD23 ' A' ' 220' ' ' LEU . 21.9 t -112.62 -29.53 2.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.238 -0.437 . . . . 70.33 111.451 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . 0.422 ' N ' HD23 ' A' ' 220' ' ' LEU . 9.4 t70 -169.03 158.59 8.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.907 0.384 . . . . 74.32 111.157 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.784 HG23 HG12 ' A' ' 131' ' ' VAL . 30.7 mt -141.52 111.53 3.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.109 -0.496 . . . . 74.31 111.182 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . 0.534 ' C ' HG22 ' A' ' 130' ' ' VAL . 33.8 t70 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.245 -0.434 . . . . 63.52 110.871 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.832 0.349 . . . . 74.15 111.163 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.78 112.93 26.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.474 . . . . 73.1 111.084 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -101.6 107.4 18.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 63.54 111.108 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.588 ' CB ' HG22 ' A' ' 215' ' ' THR . . . -85.98 174.61 9.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 63.21 111.067 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 1.059 HG11 HG21 ' A' ' 136' ' ' THR . 29.9 t -60.18 110.54 2.93 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.467 . . . . 62.52 111.103 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -79.68 142.53 16.16 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.65 2.234 . . . . 62.1 112.449 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -78.54 147.91 33.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.244 -0.435 . . . . 63.13 110.785 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.97 96.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.213 -0.449 . . . . 74.22 111.285 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.539 ' HB2' ' NZ ' ' A' ' 187' ' ' LYS . . . -66.99 -15.62 63.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 50.32 111.379 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.514 ' NE1' HD11 ' A' ' 20' ' ' LEU . 2.0 m-90 -135.64 173.79 11.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.907 0.384 . . . . 73.31 110.794 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.461 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.3 OUTLIER -117.0 153.26 32.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.978 -0.555 . . . . 72.33 110.517 179.661 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.583 HG12 ' HD2' ' A' ' 16' ' ' ARG . 31.7 t -56.31 -34.05 39.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.396 . . . . 74.45 110.975 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -72.8 -25.67 61.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.532 . . . . 44.13 111.197 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.461 ' HB2' HG23 ' A' ' 11' ' ' THR . 32.3 mt-30 -82.15 -56.57 3.85 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.821 0.343 . . . . 75.23 111.122 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.602 ' HB3' HG22 ' A' ' 60' ' ' VAL . 14.0 mt -49.55 -64.36 0.83 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.284 -0.417 . . . . 63.21 111.123 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.583 ' HD2' HG12 ' A' ' 12' ' ' VAL . 4.7 mtt-85 -54.45 -25.46 25.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.5 . . . . 73.34 111.345 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.13 173.24 0.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.023 0.44 . . . . 73.43 111.31 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -108.25 16.99 22.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.766 -0.652 . . . . 63.13 110.945 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -107.75 -23.61 12.02 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.386 -0.37 . . . . 74.4 111.065 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.814 HD22 HD11 ' A' ' 25' ' ' ILE . 10.0 tt -93.17 116.19 66.12 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.407 -0.36 . . . . 73.22 111.029 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -57.2 126.6 22.61 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.478 2.118 . . . . 74.12 112.198 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -24.11 67.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 64.42 111.203 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.538 ' HA ' HD12 ' A' ' 26' ' ' ILE . 26.4 mmtt -53.74 -36.87 62.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.375 -0.375 . . . . 71.41 111.292 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -72.67 -57.22 4.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.266 -0.425 . . . . 73.51 111.021 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.814 HD11 HD22 ' A' ' 20' ' ' LEU . 36.5 mt -44.77 -30.56 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.892 -0.594 . . . . 71.23 111.466 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.737 ' HB ' HG23 ' A' ' 47' ' ' ILE . 7.7 mt -78.08 -38.83 24.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.931 0.396 . . . . 74.03 111.03 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 mtpt -73.78 -24.9 59.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.96 -0.564 . . . . 53.01 111.131 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -72.96 -45.19 59.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.923 0.392 . . . . 75.52 110.842 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.844 HD23 HD12 ' A' ' 66' ' ' LEU . 3.2 mt -69.27 -24.53 63.98 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.911 -0.586 . . . . 75.22 111.033 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.52 ' HA ' HD11 ' A' ' 38' ' ' LEU . 64.8 mt-30 -80.0 -26.89 39.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.407 . . . . 61.45 111.112 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.425 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -101.8 -1.3 32.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.415 -0.357 . . . . 60.23 111.593 -179.889 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.425 ' CD2' ' HG3' ' A' ' 31' ' ' GLU . 94.7 m-70 -132.6 -10.9 3.14 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.857 0.317 . . . . 74.54 111.857 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.86 105.49 0.81 Allowed Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.603 -0.808 . . . . 54.11 112.372 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -31.94 152.48 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.544 0.572 . . . . 63.45 112.544 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.579 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.6 p-10 -50.09 -56.8 9.41 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.692 -0.685 . . . . 71.21 111.292 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.52 -49.96 17.82 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.032 0.444 . . . . 71.42 110.77 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.453 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 2.4 t80 -52.99 -47.26 68.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.786 -0.643 . . . . 74.1 110.321 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.693 HD21 ' O ' ' A' ' 29' ' ' LEU . 12.1 mt -66.86 -41.48 87.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.938 -0.574 . . . . 65.44 110.853 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.838 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -48.64 -41.84 32.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.093 0.473 . . . . 43.53 110.75 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -49.4 -48.28 47.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.678 -0.692 . . . . 63.3 110.93 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.418 ' CD2' ' N ' ' A' ' 41' ' ' HIS . 2.9 m-70 -103.89 14.86 29.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.042 -0.526 . . . . 74.34 111.201 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 4.8 mtmm 55.51 42.14 30.09 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.889 0.376 . . . . 51.14 111.1 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.708 HD13 HD13 ' A' ' 29' ' ' LEU . 20.3 mt -93.24 -19.43 21.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 65.44 111.532 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.838 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.73 157.81 27.07 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.04 0.448 . . . . 71.41 111.077 -179.863 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 117.73 -121.55 5.13 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.747 -0.661 . . . . 51.13 112.379 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.787 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.4 OUTLIER -116.36 116.88 28.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.773 0.321 . . . . 54.41 110.92 179.917 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.737 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.9 -54.72 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.237 -0.438 . . . . 73.32 111.33 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -47.09 -36.75 8.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 74.51 110.849 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -85.67 -26.03 26.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.93 -0.577 . . . . 73.12 110.959 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 46' ' ' ASN . 22.8 t -79.8 -26.03 12.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.293 -0.412 . . . . 70.51 111.353 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.61 -23.13 66.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 53.42 111.126 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.21 -30.43 14.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 54.23 110.758 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.2 m -98.2 33.74 2.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 62.14 111.053 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -165.4 135.05 3.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 45.23 111.027 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 p30 -94.03 177.33 6.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 74.11 110.964 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.629 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -56.04 -57.79 10.63 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.26 -0.427 . . . . 73.23 111.053 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -58.73 -28.31 65.73 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 70.33 110.577 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.27 -47.25 85.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.957 -0.565 . . . . 54.33 110.905 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.688 HD21 HG12 ' A' ' 26' ' ' ILE . 31.7 mt -73.9 -30.94 62.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.654 -0.703 . . . . 74.41 111.283 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.629 HG23 ' O ' ' A' ' 56' ' ' LYS . 22.3 t -78.84 -43.23 25.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.986 0.422 . . . . 73.34 111.007 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 96.6 m -60.48 -37.84 82.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.945 -0.571 . . . . 72.41 110.71 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.479 ' HB3' HD11 ' A' ' 43' ' ' LEU . . . -78.21 -23.41 47.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 62.24 111.081 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.666 ' HA ' HD21 ' A' ' 29' ' ' LEU . 19.2 t80 -83.96 -53.52 5.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.148 0.499 . . . . 71.14 110.656 179.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.585 ' ND2' HG12 ' A' ' 60' ' ' VAL . 31.2 m-20 -50.56 -57.01 9.15 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.514 -0.766 . . . . 73.24 111.371 -179.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.459 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 3.0 p-80 -63.47 -24.86 68.01 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.155 -0.475 . . . . 73.43 111.193 -179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.844 HD12 HD23 ' A' ' 29' ' ' LEU . 3.7 tt -51.95 -41.39 62.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.907 0.384 . . . . 54.21 110.891 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -79.04 -40.09 32.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.975 -0.557 . . . . 73.25 110.553 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -62.39 -45.19 94.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.979 -0.555 . . . . 65.42 110.676 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 72.7 p -90.75 -1.99 57.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.93 -0.577 . . . . 64.23 111.346 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.1 pttt 45.06 42.16 6.24 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.794 0.331 . . . . 74.12 111.554 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -92.11 47.24 1.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 73.25 110.884 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.517 ' CE2' HD22 ' A' ' 66' ' ' LEU . 87.3 m-85 -73.05 -175.0 1.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 75.31 110.924 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.6 tttt -75.25 153.01 38.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.415 . . . . 75.4 110.857 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -122.67 -143.81 6.53 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.771 -0.728 . . . . 62.11 112.49 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.58 99.47 8.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.827 0.346 . . . . 73.22 110.879 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -108.42 -32.55 7.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.455 . . . . 62.43 110.856 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.765 ' O ' HD13 ' A' ' 78' ' ' ILE . 4.1 m -95.79 150.67 20.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 71.34 110.91 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.765 HD13 ' O ' ' A' ' 77' ' ' SER . 25.0 mm -140.64 92.44 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 73.51 111.118 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.8 t -75.04 -33.34 61.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 74.41 110.948 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.8 ttpt 60.09 109.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 75.54 110.946 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -93.32 81.97 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.459 . . . . 74.51 111.129 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -176.82 138.91 0.28 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 73.24 110.893 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -177.9 -39.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 70.11 110.874 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -82.88 102.54 11.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.098 -0.501 . . . . 52.34 110.918 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -133.32 101.52 4.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 75.42 111.127 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -147.99 131.28 16.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 63.23 110.913 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.491 ' O ' HG13 ' A' ' 88' ' ' VAL . 1.7 t-20 -73.84 102.47 4.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 63.43 110.901 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.597 HG21 ' HB2' ' A' ' 91' ' ' ASN . 6.7 m -157.67 166.76 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 71.31 111.147 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.1 -32.07 11.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 75.52 110.928 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.3 tt -142.48 107.71 4.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 73.12 110.894 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.597 ' HB2' HG21 ' A' ' 88' ' ' VAL . 9.3 t-20 -136.24 112.26 9.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 53.03 110.908 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -157.4 152.19 25.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.145 -0.48 . . . . 65.3 110.895 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -177.11 -39.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 65.13 110.954 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -169.28 143.99 2.48 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.088 -0.506 . . . . 72.23 110.879 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.77 139.85 58.12 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.453 2.102 . . . . 72.35 112.304 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -109.14 -29.77 8.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 70.45 110.972 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -130.32 -79.05 0.54 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.456 . . . . 74.51 110.939 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.64 102.87 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.203 -0.453 . . . . 75.41 110.934 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.5 mttt -141.54 127.99 20.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 75.34 110.945 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.8 m 60.91 91.81 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 73.32 110.894 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.67 100.95 7.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 62.12 110.94 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -106.46 144.34 33.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 55.43 110.919 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 20.8 p -131.77 151.7 51.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.21 -0.45 . . . . 74.04 110.875 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -159.18 149.25 19.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 72.3 110.94 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -151.83 -173.12 4.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 64.21 110.888 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 62.49 -80.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.111 -0.495 . . . . 73.35 111.041 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 169.92 80.98 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.799 -0.715 . . . . 45.44 112.477 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.19 154.77 65.72 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.597 2.198 . . . . 45.15 112.301 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -68.89 -166.94 0.17 Allowed 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.577 2.185 . . . . 73.11 112.28 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.439 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -97.49 30.69 2.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 75.4 110.962 179.987 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.403 ' CE1' ' HB2' ' A' ' 178' ' ' ALA . 47.3 p90 -151.98 163.73 38.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 73.11 110.852 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.433 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 64.1 m -130.2 103.57 6.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 73.55 110.939 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.46 146.42 34.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 75.21 110.897 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.531 ' O ' HD12 ' A' ' 116' ' ' LEU . 2.1 m -142.23 125.75 16.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 72.14 110.925 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.517 HG13 ' CD ' ' A' ' 186' ' ' GLU . 41.8 t -72.68 106.11 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 62.44 111.451 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.531 HD12 ' O ' ' A' ' 114' ' ' SER . 6.8 mp -75.62 -60.71 2.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 73.32 110.484 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.0 ttpp -111.62 108.07 17.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.954 -0.566 . . . . 73.44 110.64 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.4 mtpt -60.21 137.37 58.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.26 -0.427 . . . . 63.21 111.024 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -104.19 -106.01 3.05 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.762 -0.733 . . . . 61.33 112.198 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.22 -43.94 11.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.958 0.408 . . . . 75.23 110.589 179.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 71.05 36.44 1.42 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.909 -0.587 . . . . 72.51 110.679 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 60.1 m -163.97 -43.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.017 -0.538 . . . . 74.21 110.768 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.35 91.72 6.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 73.21 110.952 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -103.34 149.89 37.43 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.129 -0.487 . . . . 71.33 110.906 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.613 ' HB2' HG21 ' A' ' 166' ' ' VAL . 61.2 Cg_endo -73.14 125.66 10.5 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.597 2.198 . . . . 75.03 112.387 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.91 159.38 15.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 72.55 110.8 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.418 ' HG2' ' HA3' ' A' ' 167' ' ' GLY . 0.0 OUTLIER -58.53 118.45 5.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.343 -0.39 . . . . 74.33 110.965 -179.947 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 103.0 -17.72 51.6 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.762 -0.732 . . . . 4.34 112.499 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.41 133.35 35.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.902 0.382 . . . . 74.23 110.903 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.566 HG12 ' O ' ' A' ' 224' ' ' ASP . 5.7 p -69.96 162.8 3.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.506 . . . . 63.13 110.848 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.77 HG22 ' O ' ' A' ' 164' ' ' PHE . 5.4 m -153.16 144.85 15.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.206 -0.452 . . . . 61.31 111.048 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.465 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.48 117.8 22.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.768 0.318 . . . . 71.33 110.725 179.68 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.488 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.1 p -154.76 168.87 25.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.901 0.381 . . . . 65.35 111.067 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.525 ' O ' HG13 ' A' ' 218' ' ' VAL . 65.2 m95 -102.91 162.62 12.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.012 -0.54 . . . . 71.43 110.195 179.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.69 ' H ' HD11 ' A' ' 149' ' ' ILE . 33.2 p90 -159.93 135.2 8.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.982 0.42 . . . . 72.53 111.458 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 1.059 HG21 HG11 ' A' ' 5' ' ' VAL . 6.8 m -129.32 115.38 17.5 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.847 -0.615 . . . . 62.31 110.337 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.597 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.82 144.26 17.15 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.619 -0.8 . . . . 73.35 113.108 -179.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.74 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -148.11 145.98 28.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.784 0.326 . . . . 74.22 110.548 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 21.9 mt -82.27 -177.97 6.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.277 -0.42 . . . . 64.24 111.159 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -57.63 -42.48 83.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 72.32 110.937 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.94 -5.4 46.0 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.016 -0.538 . . . . 50.53 111.405 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.64 25.84 26.64 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.64 -0.79 . . . . 73.53 112.546 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -95.35 112.2 23.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.339 . . . . 53.12 110.771 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.574 ' CG1' HG23 ' A' ' 138' ' ' THR . 2.5 m -63.6 144.15 14.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.436 . . . . 73.52 111.17 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.434 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 42.2 p90 -120.92 -36.56 3.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 73.53 111.284 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . 0.404 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 59.7 m-20 -158.07 118.04 3.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.906 0.384 . . . . 71.21 111.355 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.444 ' OG1' HG23 ' A' ' 136' ' ' THR . 14.7 t -142.94 129.46 20.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.514 . . . . 64.5 110.491 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.692 ' C ' HD12 ' A' ' 149' ' ' ILE . 19.8 p-10 -96.22 39.32 1.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.8 0.333 . . . . 74.33 111.1 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.692 HD12 ' C ' ' A' ' 148' ' ' ASN . 2.7 mp -125.64 118.04 51.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 74.31 110.713 179.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -118.29 -77.17 0.57 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.233 -0.439 . . . . 64.33 110.918 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 25.2 p -146.5 166.03 27.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.441 . . . . 62.22 110.942 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.6 m -85.19 -176.33 6.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 72.41 110.892 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -75.25 -23.7 57.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 73.01 111.29 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.6 pttp -54.88 -30.0 57.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.373 -0.376 . . . . 70.43 111.087 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -91.29 -38.17 12.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 74.23 110.89 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 30.0 pttt -179.18 156.89 0.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.061 -0.518 . . . . 61.42 110.859 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 4.9 mtmt -86.12 76.22 9.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 55.11 110.892 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -154.12 47.67 0.61 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.479 . . . . 74.15 110.835 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.19 111.48 2.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.056 -0.52 . . . . 63.44 111.04 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -136.83 138.4 26.01 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 73.05 110.904 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.76 151.62 31.6 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.384 2.056 . . . . 72.41 112.359 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.569 ' O ' HD23 ' A' ' 162' ' ' LEU . 4.6 tt -76.08 119.95 20.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 61.23 110.572 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.62 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -98.68 122.17 41.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.907 0.384 . . . . 72.51 111.273 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.77 ' O ' HG22 ' A' ' 131' ' ' VAL . 8.4 p90 -151.62 143.55 23.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.014 -0.539 . . . . 75.1 110.724 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.532 ' O ' HG22 ' A' ' 168' ' ' VAL . 14.7 mtmm -80.92 139.11 36.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.082 0.468 . . . . 74.42 111.129 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.613 HG21 ' HB2' ' A' ' 125' ' ' PRO . 34.1 m -87.46 149.46 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.71 -0.677 . . . . 70.23 111.44 -179.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . 0.418 ' HA3' ' HG2' ' A' ' 127' ' ' LYS . . . 70.51 22.54 77.84 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.82 -0.627 . . . . 64.14 112.768 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.614 HG23 ' CG ' ' A' ' 170' ' ' LYS . 17.1 m -129.38 42.29 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 75.42 111.096 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.69 37.47 5.14 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 121.143 -0.551 . . . . 73.22 113.088 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . 0.614 ' CG ' HG23 ' A' ' 168' ' ' VAL . 3.0 mmpt? -86.02 -36.8 19.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.819 0.342 . . . . 61.52 111.131 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.6 m -126.76 179.39 3.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.457 . . . . 72.21 111.19 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.543 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -60.57 159.45 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 73.21 111.301 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -67.41 -27.8 67.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 74.41 111.199 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.96 -36.97 39.75 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.662 -0.78 . . . . 74.04 112.059 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.67 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.4 t90 -78.3 -34.15 48.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.957 0.408 . . . . 74.21 111.113 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . 0.808 ' O ' HD13 ' A' ' 180' ' ' LEU . 35.1 t70 -66.78 -32.21 73.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.948 -0.569 . . . . 54.43 110.675 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -79.06 -29.82 43.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.48 . . . . 72.33 110.837 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.656 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -82.58 -52.38 6.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.234 -0.439 . . . . 75.44 111.181 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.566 HD21 ' NE1' ' A' ' 175' ' ' TRP . 10.2 mt -58.4 -34.89 71.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.988 -0.551 . . . . 73.22 110.842 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.808 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.6 mp -53.68 -37.62 63.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 70.3 111.084 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 39.2 p -84.18 1.99 41.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.037 -0.529 . . . . 73.03 111.518 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.15 151.38 33.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.765 0.317 . . . . 71.24 110.863 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.72 165.76 11.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.291 -0.413 . . . . 71.42 110.938 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.89 124.97 23.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.08 -0.509 . . . . 73.02 111.021 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 67.8 44.15 81.25 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.84 -0.695 . . . . 63.22 112.841 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . 0.517 ' CD ' HG13 ' A' ' 115' ' ' VAL . 13.4 tt0 -126.91 149.94 49.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.581 0.229 . . . . 52.2 110.528 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . 0.539 ' NZ ' ' HB2' ' A' ' 9' ' ' ALA . 4.7 ttmt -117.95 138.17 52.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.098 -0.334 . . . . 64.43 110.098 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -148.23 175.85 10.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.075 0.464 . . . . 54.4 111.846 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.13 133.6 33.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.607 -0.724 . . . . 71.33 109.584 178.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.656 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.1 pt? -140.34 141.18 35.69 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.158 0.504 . . . . 73.53 112.045 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.68 110.36 18.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.587 -0.733 . . . . 72.04 110.257 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.482 HD11 ' CZ ' ' A' ' 216' ' ' PHE . 2.1 mp -96.25 139.44 19.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.916 0.389 . . . . 74.12 111.344 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -73.64 166.38 44.69 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.945 -0.57 . . . . 74.35 110.964 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.56 -14.34 41.87 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.676 2.25 . . . . 73.44 112.608 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -80.38 -30.01 37.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.814 0.34 . . . . 72.43 111.028 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.439 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 15.3 m0 -111.06 36.9 2.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.29 -0.413 . . . . 71.33 111.004 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -153.16 -78.4 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.256 -0.429 . . . . 74.52 111.018 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . 0.668 ' CE2' HD11 ' A' ' 214' ' ' LEU . 24.0 m-85 -106.92 -71.17 0.76 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 62.1 110.792 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 145.74 176.04 19.32 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.83 -0.7 . . . . 51.43 112.596 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -57.5 -25.58 60.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.728 0.299 . . . . 72.22 111.005 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -74.68 -52.02 12.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.998 0.427 . . . . 74.25 110.863 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.78 174.01 24.67 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.854 -0.689 . . . . 54.21 112.533 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.429 ' CB ' HD12 ' A' ' 208' ' ' ILE . 0.0 OUTLIER -106.32 91.27 5.54 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.66 0.267 . . . . 75.1 110.845 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 203' ' ' GLN . 37.4 Cg_endo -66.22 -21.61 54.84 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.509 2.139 . . . . 74.01 112.445 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.39 -41.84 94.65 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.383 -0.371 . . . . 71.11 110.932 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -105.96 30.0 6.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 72.32 111.126 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 21.6 mttp 56.8 29.43 16.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 72.24 111.044 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.606 HD13 ' CE2' ' A' ' 198' ' ' TYR . 30.3 mt -91.11 111.77 50.3 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.304 -0.407 . . . . 60.42 111.013 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -68.55 171.23 13.43 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.461 2.107 . . . . 73.31 112.401 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -67.01 145.84 75.16 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.587 2.191 . . . . 74.41 112.253 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 48.92 73.61 0.22 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.255 -0.429 . . . . 71.25 111.152 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -127.37 113.66 16.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.312 -0.404 . . . . 50.24 111.479 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.08 116.5 6.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.054 -0.521 . . . . 74.04 110.44 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.668 HD11 ' CE2' ' A' ' 198' ' ' TYR . 11.1 mt -93.46 109.87 21.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.162 -0.472 . . . . 63.14 111.568 -179.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.588 HG22 ' CB ' ' A' ' 4' ' ' ALA . 96.4 m -107.43 138.13 44.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.935 -0.575 . . . . 65.15 110.303 179.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.597 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 14.9 p90 -155.33 179.38 9.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.082 0.467 . . . . 73.24 111.552 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -133.48 136.85 45.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.686 -0.688 . . . . 75.31 110.748 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.67 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.0 t -121.8 151.21 25.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.168 -0.469 . . . . 34.41 111.756 -179.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -136.74 108.78 7.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.793 -0.639 . . . . 71.22 110.365 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.892 HD13 HD11 ' A' ' 223' ' ' ILE . 0.7 OUTLIER -69.83 128.56 36.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.364 -0.38 . . . . 61.32 110.829 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 39.3 t -108.7 -30.05 2.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.25 -0.432 . . . . 71.2 111.023 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -167.14 156.81 10.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.354 -0.384 . . . . 72.42 110.948 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.892 HD11 HD13 ' A' ' 220' ' ' LEU . 4.4 mp -142.75 112.35 2.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.239 -0.437 . . . . 75.43 111.097 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . 0.566 ' O ' HG12 ' A' ' 130' ' ' VAL . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 61.52 110.89 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.854 0.359 . . . . 64.0 111.149 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.7 105.1 15.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 72.01 111.107 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -158.68 59.56 0.43 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 74.42 111.037 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -164.55 123.91 1.9 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 43.11 111.052 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 1.037 HG11 HG21 ' A' ' 136' ' ' THR . 44.7 t -60.21 110.46 2.87 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 72.12 110.951 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.443 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 80.3 Cg_endo -78.56 141.96 18.0 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.713 2.275 . . . . 62.02 112.473 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.406 HE22 HD11 ' A' ' 149' ' ' ILE . 5.5 mm100 -79.91 149.35 30.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.126 -0.488 . . . . 73.45 110.975 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.429 ' HD2' HD13 ' A' ' 149' ' ' ILE . 0.0 OUTLIER -49.86 116.61 1.88 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 72.04 111.162 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.29 -13.9 34.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.146 -0.479 . . . . 55.23 111.576 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.678 ' CD1' HD11 ' A' ' 20' ' ' LEU . 2.0 m-90 -137.94 173.73 11.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.961 0.41 . . . . 73.41 110.966 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 m -117.51 151.8 36.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.944 -0.571 . . . . 51.33 110.741 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.554 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.8 t -56.7 -33.09 39.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.948 0.404 . . . . 63.51 110.824 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -75.4 -25.61 57.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.949 -0.568 . . . . 75.32 111.017 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -82.12 -57.45 3.39 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.831 0.348 . . . . 74.14 110.929 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.708 HD23 HG12 ' A' ' 25' ' ' ILE . 1.0 OUTLIER -49.7 -62.98 1.25 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.241 -0.436 . . . . 70.42 111.006 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.554 ' HD2' HG12 ' A' ' 12' ' ' VAL . 17.9 mtt180 -54.07 -24.09 16.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.087 -0.506 . . . . 70.22 111.291 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.31 176.84 0.11 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.891 0.377 . . . . 72.41 111.168 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -110.38 16.81 21.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.98 -0.554 . . . . 72.55 111.194 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -108.9 -24.81 11.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.521 -0.309 . . . . 75.43 111.165 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.678 HD11 ' CD1' ' A' ' 10' ' ' TRP . 1.8 tt -90.95 111.69 49.59 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.388 -0.369 . . . . 75.11 111.03 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -55.97 128.09 28.8 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.448 2.099 . . . . 75.22 112.211 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.874 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -62.66 -24.16 67.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 73.32 111.222 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.468 ' HA ' HD12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -52.04 -41.62 62.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.425 -0.352 . . . . 75.3 111.472 -179.747 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.95 -57.34 4.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.197 -0.456 . . . . 53.01 111.104 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.874 HD12 ' HA ' ' A' ' 22' ' ' LYS . 4.9 mt -44.96 -30.49 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.858 -0.61 . . . . 70.4 111.613 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.665 HG12 HD21 ' A' ' 59' ' ' LEU . 7.5 mt -77.74 -37.85 24.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.938 0.399 . . . . 70.24 110.969 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -73.11 -23.75 60.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.062 -0.517 . . . . 71.31 111.03 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.452 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 34.6 t80 -73.22 -47.02 46.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.06 0.457 . . . . 75.21 110.99 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.815 HD21 ' HA ' ' A' ' 63' ' ' TYR . 4.3 mt -69.11 -27.77 65.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.782 -0.645 . . . . 74.23 111.136 -179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.476 ' HA ' HD11 ' A' ' 38' ' ' LEU . 36.2 mt-30 -75.69 -29.26 58.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.405 . . . . 72.41 110.987 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.405 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 12.7 pt-20 -93.34 -39.65 10.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.253 -0.43 . . . . 71.21 111.113 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.452 ' ND1' ' CZ ' ' A' ' 28' ' ' PHE . 18.3 m170 -90.27 -5.0 56.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.294 -0.412 . . . . 64.41 111.448 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.01 161.94 15.96 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.712 -0.756 . . . . 70.45 112.425 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.81 153.38 18.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.62 0.248 . . . . 71.14 110.501 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.699 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.3 p-10 -48.83 -56.97 7.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.77 0.319 . . . . 74.42 111.066 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.14 -51.24 25.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.053 0.454 . . . . 45.24 110.803 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.508 ' CE1' ' CE1' ' A' ' 65' ' ' HIS . 16.5 t80 -53.07 -48.09 67.98 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.803 -0.635 . . . . 71.53 110.453 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.522 HD21 ' O ' ' A' ' 29' ' ' LEU . 13.3 mt -66.18 -40.67 90.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.055 -0.521 . . . . 64.23 110.775 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.767 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.65 -48.19 28.96 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.03 0.443 . . . . 34.13 111.1 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -57.33 -26.68 61.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.713 -0.676 . . . . 34.31 110.94 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.406 ' NE2' ' CE1' ' A' ' 65' ' ' HIS . 67.8 m-70 -112.57 11.07 19.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.283 -0.417 . . . . 74.54 111.248 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.89 34.79 11.0 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.817 0.341 . . . . 62.44 110.901 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.694 HD13 HD13 ' A' ' 29' ' ' LEU . 23.2 mt -93.29 -20.65 20.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 73.33 111.736 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.767 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -79.39 158.89 27.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.031 0.443 . . . . 71.03 111.102 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.61 -119.6 4.64 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.775 -0.648 . . . . 51.23 112.453 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.883 ' O ' HG23 ' A' ' 50' ' ' VAL . 0.5 OUTLIER -116.4 115.16 25.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.803 0.335 . . . . 61.03 110.891 179.947 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.634 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.41 -57.66 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.164 -0.471 . . . . 73.51 111.499 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -45.68 -37.25 5.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.804 -0.634 . . . . 73.43 111.076 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -85.75 -25.92 26.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.566 . . . . 51.33 111.086 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 46' ' ' ASN . 19.2 t -81.14 -26.36 10.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.304 -0.407 . . . . 60.12 111.459 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.99 -18.02 64.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.403 -0.362 . . . . 64.33 111.365 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -95.2 -34.53 12.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.42 -0.355 . . . . 51.21 111.076 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.46 -19.74 35.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 74.22 111.409 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -116.16 139.26 50.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 64.42 111.255 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -91.42 -177.47 4.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.151 -0.477 . . . . 74.13 110.74 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.566 ' O ' HG23 ' A' ' 60' ' ' VAL . 23.1 mmmt -59.59 -58.02 10.42 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.457 -0.338 . . . . 55.33 110.91 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.94 -27.87 65.73 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.205 -0.452 . . . . 74.44 110.625 179.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.77 -43.11 99.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.958 -0.564 . . . . 72.4 110.756 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.665 HD21 HG12 ' A' ' 26' ' ' ILE . 29.1 mt -76.35 -28.85 56.98 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.687 -0.688 . . . . 75.1 111.196 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.6 HG22 ' HB3' ' A' ' 15' ' ' LEU . 18.2 t -80.42 -43.93 21.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.001 0.429 . . . . 72.44 110.685 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 72.4 m -59.29 -33.98 71.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.88 -0.6 . . . . 71.35 110.457 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.455 ' HB3' HD11 ' A' ' 43' ' ' LEU . . . -83.23 -21.97 33.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 62.14 110.942 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.815 ' HA ' HD21 ' A' ' 29' ' ' LEU . 15.6 t80 -83.64 -22.84 32.05 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.171 -0.468 . . . . 60.15 111.113 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.52 ' ND2' HG12 ' A' ' 60' ' ' VAL . 34.2 m-80 -84.56 -53.9 5.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.074 0.464 . . . . 70.04 111.321 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.589 ' HD2' HG21 ' A' ' 69' ' ' THR . 2.9 p-80 -60.43 -29.23 68.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.003 -0.544 . . . . 74.23 111.022 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.694 HD12 HD23 ' A' ' 29' ' ' LEU . 5.5 tt -46.73 -42.09 16.17 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.877 0.37 . . . . 71.33 110.985 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.42 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 5.8 m-85 -78.14 -41.08 36.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.997 -0.547 . . . . 54.43 110.276 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -70.31 -13.02 61.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.899 -0.592 . . . . 72.32 111.02 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.589 HG21 ' HD2' ' A' ' 65' ' ' HIS . 39.3 p -110.6 -16.16 13.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.267 -0.424 . . . . 64.2 111.259 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.667 ' HD3' HG21 ' A' ' 144' ' ' VAL . 10.9 mtmm 57.41 29.95 17.79 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.784 0.326 . . . . 73.32 111.043 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.1 mtt85 -95.1 44.07 1.09 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 71.43 110.993 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.433 ' CD2' ' HD2' ' A' ' 6' ' ' PRO . 61.5 m-85 -66.29 174.63 2.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 71.14 110.758 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -69.25 113.02 6.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.293 -0.412 . . . . 75.34 110.856 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -102.92 -179.44 26.51 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.722 -0.752 . . . . 75.12 112.478 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 40.9 p -84.77 140.27 31.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.862 0.363 . . . . 70.11 110.895 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -152.56 117.01 4.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 51.21 110.893 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 5.5 t 61.35 154.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 72.3 110.893 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 4.7 mt -117.6 114.31 45.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.446 . . . . 64.43 111.111 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.73 164.9 16.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 72.25 110.936 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 28.6 tttt -107.11 147.05 30.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 64.41 110.899 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 12.9 m -84.92 -31.88 7.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 71.32 111.118 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.9 m -80.4 172.62 13.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 63.33 110.904 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -177.6 -39.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 63.34 110.964 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -97.38 -32.86 11.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.103 -0.499 . . . . 65.21 110.905 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.536 HG13 ' O ' ' A' ' 85' ' ' VAL . 11.2 p -138.36 116.38 12.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.449 . . . . 73.41 111.082 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.6 145.54 43.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.431 . . . . 63.25 110.913 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -130.49 117.66 19.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 71.32 110.873 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.561 ' O ' HG13 ' A' ' 88' ' ' VAL . 11.1 p -159.04 113.27 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 65.43 111.075 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.28 81.37 0.18 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 71.43 110.878 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.3 mt -148.86 157.03 43.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 61.35 110.918 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -83.31 -31.88 26.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 74.44 110.931 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -86.65 145.52 26.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 63.04 110.931 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -140.87 133.83 29.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 73.32 110.913 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -147.5 149.25 33.65 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 45.14 110.901 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.5 130.95 19.25 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.548 2.165 . . . . 61.35 112.341 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? -110.94 -33.71 6.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 71.41 110.92 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -177.13 -39.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 72.31 110.905 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.1 m 60.42 158.41 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.091 -0.504 . . . . 71.23 110.917 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.2 mmtp -109.31 -32.47 7.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 75.11 110.884 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.3 m -164.46 144.29 7.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 52.24 110.896 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -141.35 96.32 2.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.162 -0.472 . . . . 71.23 110.868 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -98.53 -68.33 0.81 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 73.14 110.882 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.3 m 60.22 158.71 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.982 -0.553 . . . . 61.31 110.949 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tp -111.13 145.93 37.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 62.45 110.884 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -174.88 -40.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 73.15 110.915 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -75.74 -31.54 59.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.112 -0.495 . . . . 74.52 110.921 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 74.76 56.95 4.7 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.716 -0.754 . . . . 61.24 112.488 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.07 176.17 7.37 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.583 2.189 . . . . 65.24 112.283 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.438 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 44.0 Cg_exo -56.7 -162.62 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.637 2.225 . . . . 75.15 112.268 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -98.25 29.07 3.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 54.33 110.97 -179.997 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.438 ' CD1' ' HB2' ' A' ' 109' ' ' PRO . 6.2 p90 -160.99 -171.89 3.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 74.2 110.809 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 18.7 m -156.44 103.71 2.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 75.41 111.282 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.491 ' HD2' ' HB1' ' A' ' 178' ' ' ALA . 15.3 tttt -100.45 150.99 22.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.202 -0.454 . . . . 72.22 110.66 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.401 ' O ' HD22 ' A' ' 116' ' ' LEU . 65.6 m -145.49 123.11 11.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.35 -0.386 . . . . 72.43 111.037 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 32.7 t -80.77 106.36 11.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 50.31 111.187 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.533 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.1 mm? -82.27 -41.56 20.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.448 . . . . 74.1 110.683 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 8.3 tptt -125.29 108.08 11.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 73.45 110.825 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.0 mtmp? -62.1 139.27 58.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 63.41 110.945 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -110.96 -158.48 15.54 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.719 -0.753 . . . . 70.4 112.408 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -35.88 -49.21 0.61 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.913 0.387 . . . . 75.32 111.708 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.553 ' O ' HG23 ' A' ' 122' ' ' THR . 1.2 tmtt? 72.89 37.71 0.79 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.994 -0.548 . . . . 73.24 110.298 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.553 HG23 ' O ' ' A' ' 121' ' ' LYS . 0.8 OUTLIER -164.43 -44.05 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.729 -0.669 . . . . 63.21 110.55 179.874 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -84.82 91.7 8.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.066 -0.515 . . . . 71.25 110.671 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -108.89 154.98 41.55 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.466 . . . . 72.42 110.885 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.611 ' HB2' HG21 ' A' ' 166' ' ' VAL . 62.8 Cg_endo -73.58 125.63 10.23 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.546 2.164 . . . . 74.13 112.407 -179.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.07 157.37 15.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 71.01 110.891 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.0 115.36 3.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 62.41 110.958 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 108.02 -24.02 24.11 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.732 -0.747 . . . . 71.15 112.568 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -84.54 135.27 34.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 63.13 110.797 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.687 HG12 ' HG3' ' A' ' 165' ' ' LYS . 22.7 m -68.21 171.69 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.29 -0.414 . . . . 70.31 111.191 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.907 HG22 ' O ' ' A' ' 164' ' ' PHE . 10.9 m -156.13 145.31 12.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.863 -0.608 . . . . 73.54 110.593 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.437 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.3 OUTLIER -127.6 117.59 22.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.702 0.286 . . . . 75.21 110.818 179.595 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.654 ' HB3' HD22 ' A' ' 220' ' ' LEU . 30.1 p -153.47 169.09 24.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.965 0.412 . . . . 64.15 111.085 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.554 ' HB3' HD11 ' A' ' 149' ' ' ILE . 39.5 m95 -102.5 160.51 14.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.94 -0.573 . . . . 55.4 110.102 179.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.434 ' CD1' ' N ' ' A' ' 135' ' ' TYR . 3.2 p90 -158.84 134.7 8.87 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.734 -0.386 . . . . 73.44 111.591 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 1.037 HG21 HG11 ' A' ' 5' ' ' VAL . 57.0 m -127.63 112.5 14.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.958 -0.564 . . . . 62.44 110.553 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.643 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -94.55 143.84 16.81 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.601 -0.809 . . . . 24.1 113.197 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.739 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -151.58 131.01 12.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.724 0.297 . . . . 75.54 110.384 179.717 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.589 HD21 HD12 ' A' ' 208' ' ' ILE . 83.2 mt -59.24 -178.74 0.06 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.399 -0.364 . . . . 52.14 110.951 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -55.24 -40.9 71.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 65.11 110.852 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -82.56 0.67 41.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.012 -0.54 . . . . 72.21 111.476 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.75 25.82 26.46 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.612 -0.804 . . . . 63.54 112.64 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . 0.563 ' HB ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -81.17 108.67 15.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.778 0.323 . . . . 73.42 110.873 179.997 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.667 HG21 ' HD3' ' A' ' 70' ' ' LYS . 27.5 t -65.89 124.46 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.449 . . . . 74.12 111.161 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.823 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 17.7 p90 -111.49 -28.41 8.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 71.32 111.013 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -161.19 115.33 2.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.31 -0.405 . . . . 62.12 111.007 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.608 HG22 ' H ' ' A' ' 149' ' ' ILE . 55.1 m -125.36 116.41 21.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 53.14 110.891 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -86.12 14.65 6.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.921 -0.581 . . . . 55.54 111.636 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.608 ' H ' HG22 ' A' ' 147' ' ' THR . 14.8 mt -124.08 122.78 65.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.767 0.318 . . . . 65.11 111.429 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -142.07 -66.67 0.4 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.302 -0.408 . . . . 75.31 111.03 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.59 163.86 12.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.292 -0.413 . . . . 65.32 110.987 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.3 m -116.06 150.41 37.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.193 -0.458 . . . . 73.31 110.814 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.89 71.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 73.11 111.13 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? -74.05 -31.46 62.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 71.15 110.911 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -84.61 -34.62 23.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 75.04 110.896 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -177.29 143.55 0.38 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 75.35 110.874 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 25.2 mttm -74.43 76.72 1.91 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 71.14 110.869 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -154.4 40.38 0.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 73.42 110.823 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.2 120.05 3.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.113 -0.494 . . . . 31.34 111.036 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 4.3 mmtm -138.97 145.94 47.61 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.304 -0.407 . . . . 60.23 110.875 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.09 147.92 61.8 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.492 2.128 . . . . 70.14 112.339 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.527 HD23 ' C ' ' A' ' 162' ' ' LEU . 3.9 tt -69.38 124.72 24.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 75.4 110.682 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.664 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.29 119.64 38.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.862 0.363 . . . . 53.42 111.081 179.803 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.907 ' O ' HG22 ' A' ' 131' ' ' VAL . 5.3 p90 -149.39 140.82 23.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 70.14 110.855 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.687 ' HG3' HG12 ' A' ' 130' ' ' VAL . 75.8 mttt -78.69 139.51 38.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.009 0.433 . . . . 52.31 110.925 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.611 HG21 ' HB2' ' A' ' 125' ' ' PRO . 29.6 m -87.97 148.91 4.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.874 -0.603 . . . . 53.52 111.373 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.1 24.63 74.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.885 -0.674 . . . . 52.42 112.875 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.721 HG23 ' HG3' ' A' ' 170' ' ' LYS . 5.3 m -129.1 42.67 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.821 0.343 . . . . 52.11 111.101 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 41.8 35.45 1.51 Allowed Glycine 0 C--N 1.332 0.33 0 CA-C-N 116.046 -0.525 . . . . 72.23 113.319 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . 0.721 ' HG3' HG23 ' A' ' 168' ' ' VAL . 6.1 mtpp -86.24 -43.65 12.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.814 0.34 . . . . 75.41 111.163 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 5.7 m -115.24 178.17 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.195 -0.457 . . . . 75.23 110.988 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.553 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.92 160.91 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.317 -0.401 . . . . 63.2 111.192 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 3.6 ttp-105 -67.81 -29.05 68.12 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.235 -0.438 . . . . 74.23 111.044 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.9 -37.19 44.9 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.659 -0.781 . . . . 65.14 112.081 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.718 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.0 t90 -78.73 -33.99 46.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.973 0.416 . . . . 74.33 110.983 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . 0.775 ' O ' HD13 ' A' ' 180' ' ' LEU . 4.1 t70 -63.87 -33.87 76.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.872 -0.604 . . . . 62.43 110.497 179.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -78.73 -29.42 45.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.016 -0.538 . . . . 72.0 110.706 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.629 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -80.0 -56.11 4.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 61.24 111.126 179.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.667 HD21 ' NE1' ' A' ' 175' ' ' TRP . 12.5 mt -61.65 -18.96 61.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.899 -0.592 . . . . 74.45 111.128 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.775 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.5 tp -58.38 -27.15 63.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.357 -0.383 . . . . 63.34 111.26 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 47.8 p -111.52 14.01 21.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.494 -0.321 . . . . 75.11 111.717 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.819 ' SD ' HD23 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -71.57 100.72 2.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.882 0.372 . . . . 74.44 110.691 179.869 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.53 159.46 24.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 75.35 111.255 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.52 116.11 4.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.859 -0.61 . . . . 70.21 111.038 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 79.17 11.84 84.64 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.936 -0.649 . . . . 54.01 113.075 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -87.39 146.31 25.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.963 0.411 . . . . 75.22 111.211 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.2 ttpt -119.57 135.71 54.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.003 -0.544 . . . . 71.22 109.928 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -150.11 176.37 10.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.099 0.476 . . . . 63.33 111.9 -179.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . 0.404 ' CB ' ' HG2' ' A' ' 217' ' ' GLU . 0.0 OUTLIER -137.43 138.29 39.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.577 -0.738 . . . . 74.21 109.462 178.782 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.661 HD23 ' N ' ' A' ' 190' ' ' LEU . 1.1 pt? -140.15 138.16 35.0 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.281 0.562 . . . . 75.22 112.41 -179.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.751 ' HG2' HG23 ' A' ' 215' ' ' THR . 6.7 mt-10 -113.46 112.61 23.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.235 -0.893 . . . . 74.34 109.86 179.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.477 HD12 ' CE2' ' A' ' 216' ' ' PHE . 1.9 mp -106.6 147.08 12.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.001 0.429 . . . . 73.33 111.596 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.413 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 0.1 OUTLIER -77.1 167.17 38.89 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.902 -0.59 . . . . 74.12 110.61 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 27.8 Cg_endo -62.4 -29.49 79.32 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.464 2.11 . . . . 70.43 112.384 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -66.15 -38.89 89.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.261 -0.427 . . . . 71.15 111.143 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.445 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 18.8 m0 -96.88 36.9 1.35 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.357 -0.383 . . . . 70.43 111.027 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -158.66 -81.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 64.54 110.836 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -106.17 -71.39 0.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.972 0.415 . . . . 61.54 110.61 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 144.0 -176.0 23.55 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.756 -0.735 . . . . 50.24 112.743 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt -57.36 -35.26 69.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.866 0.365 . . . . 73.31 110.899 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -52.26 62.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 75.13 110.616 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.26 -143.68 15.73 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.878 -0.677 . . . . 74.12 112.559 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.411 ' HA ' ' HD2' ' A' ' 204' ' ' PRO . 0.8 OUTLIER -151.97 91.15 3.75 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.606 0.241 . . . . 63.14 110.595 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 203' ' ' GLN . 21.5 Cg_endo -61.28 -24.21 78.43 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.548 2.165 . . . . 71.52 112.636 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.69 -42.14 74.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.887 0.375 . . . . 73.15 110.862 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.823 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -99.63 26.69 5.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.031 -0.531 . . . . 63.15 111.325 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.53 32.26 13.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.374 -0.376 . . . . 75.35 111.149 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.589 HD12 HD21 ' A' ' 139' ' ' LEU . 19.1 mm -93.78 111.76 54.07 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 62.34 111.11 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . 0.588 ' HG2' ' HB2' ' A' ' 212' ' ' ALA . 53.6 Cg_endo -69.44 171.1 14.71 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.362 2.042 . . . . 63.51 112.217 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.33 120.75 7.92 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.492 2.128 . . . . 61.33 112.223 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 63.15 71.23 0.52 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 72.43 110.766 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . 0.588 ' HB2' ' HG2' ' A' ' 209' ' ' PRO . . . -123.09 129.06 50.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 54.05 111.432 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 2.5 tttt -65.43 139.4 58.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.022 -0.535 . . . . 75.33 110.723 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.87 109.6 15.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.416 -0.356 . . . . 74.32 111.318 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.751 HG23 ' HG2' ' A' ' 191' ' ' GLU . 61.2 m -107.88 141.83 38.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 61.53 110.643 179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.643 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 27.0 p90 -158.42 -178.83 7.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.066 0.46 . . . . 73.23 111.684 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . 0.404 ' HG2' ' CB ' ' A' ' 189' ' ' ARG . 3.0 mt-10 -136.86 140.37 42.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.746 -0.661 . . . . 72.4 110.601 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.718 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.4 t -123.93 152.23 29.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.108 0.48 . . . . 63.43 111.913 -178.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -136.64 109.78 7.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.635 -0.711 . . . . 74.32 110.289 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.819 HD23 ' SD ' ' A' ' 182' ' ' MET . 0.2 OUTLIER -69.8 128.7 37.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.401 -0.363 . . . . 62.11 110.776 -179.681 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.42 -32.51 2.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.21 -0.45 . . . . 72.45 111.516 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -169.37 159.78 8.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.866 0.365 . . . . 70.14 111.077 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.675 HD11 HD12 ' A' ' 220' ' ' LEU . 3.4 mp -140.83 110.31 3.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.046 -0.524 . . . . 72.15 111.077 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.421 . . . . 52.52 110.916 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 mtt . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.752 0.31 . . . . 64.34 111.171 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.97 99.67 2.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 54.44 111.186 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.581 ' O ' ' HB2' ' A' ' 4' ' ' ALA . . . -98.31 178.07 5.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 75.52 111.031 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 3' ' ' ALA . . . 165.97 85.61 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.251 -0.432 . . . . 73.31 111.172 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.866 HG11 HG21 ' A' ' 136' ' ' THR . 48.4 t -89.31 110.8 41.29 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.466 -0.334 . . . . 35.11 110.642 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.453 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 87.1 Cg_endo -79.04 136.08 12.78 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.61 2.207 . . . . 45.41 112.582 -179.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -78.81 157.44 28.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 74.4 110.882 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.91 95.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 61.45 111.171 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.05 -18.0 63.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.489 . . . . 65.23 111.436 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.637 ' CE2' HD11 ' A' ' 20' ' ' LEU . 1.3 m-90 -137.2 173.74 11.36 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.94 0.4 . . . . 71.52 110.897 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.9 m -115.46 150.17 36.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.976 -0.556 . . . . 74.42 110.642 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.454 HG12 ' HD2' ' A' ' 16' ' ' ARG . 38.5 t -56.66 -31.79 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.917 0.389 . . . . 72.03 110.621 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -77.09 -25.56 52.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.968 -0.56 . . . . 72.21 111.042 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -82.21 -58.09 3.1 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.856 0.36 . . . . 75.33 110.833 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.772 ' HB3' HG22 ' A' ' 60' ' ' VAL . 2.6 mt -50.53 -61.08 2.4 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.196 -0.456 . . . . 63.02 111.004 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.568 ' HG3' HG11 ' A' ' 60' ' ' VAL . 22.3 mtt180 -54.16 -24.0 16.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.092 -0.504 . . . . 74.1 111.207 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.81 176.11 0.22 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.936 0.398 . . . . 60.52 111.115 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -110.3 16.65 21.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.022 -0.536 . . . . 71.52 111.161 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -106.9 -25.62 11.58 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.564 -0.289 . . . . 74.13 111.068 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.637 HD11 ' CE2' ' A' ' 10' ' ' TRP . 2.5 tt -88.05 112.69 50.95 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.413 -0.358 . . . . 42.42 110.957 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.37 125.46 18.99 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.433 2.088 . . . . 64.32 112.368 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.5 -24.12 66.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.162 -0.472 . . . . 75.22 111.156 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.498 ' HA ' HD12 ' A' ' 26' ' ' ILE . 0.6 OUTLIER -54.0 -40.01 66.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.393 -0.367 . . . . 72.24 111.343 -179.786 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.52 -56.79 5.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.219 -0.446 . . . . 72.02 111.063 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.9 mt -44.82 -31.37 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.88 -0.6 . . . . 75.42 111.446 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.647 HG12 HD21 ' A' ' 59' ' ' LEU . 7.7 mt -76.81 -38.8 30.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.931 0.396 . . . . 75.12 110.98 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -72.92 -24.67 60.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.988 -0.551 . . . . 74.01 111.075 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -71.46 -46.83 58.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.035 0.445 . . . . 74.12 110.812 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.813 HD21 ' HA ' ' A' ' 63' ' ' TYR . 6.4 mt -67.77 -25.03 65.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.838 -0.619 . . . . 72.33 110.994 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -78.55 -24.52 45.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.249 -0.432 . . . . 54.51 111.09 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 10.6 pt-20 -93.92 -41.29 9.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.808 0.337 . . . . 73.03 110.838 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.453 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 35.6 m170 -97.28 16.59 19.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 72.12 110.955 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.95 153.7 23.42 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.795 -0.717 . . . . 72.43 112.507 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.7 p -90.62 152.96 20.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.628 0.252 . . . . 40.04 110.507 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.657 ' O ' HD23 ' A' ' 44' ' ' LEU . 1.1 p-10 -49.32 -57.05 7.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.691 0.281 . . . . 71.21 111.116 -179.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.8 t -47.95 -50.68 26.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.009 0.433 . . . . 65.14 110.685 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.458 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 9.0 t80 -53.56 -47.16 70.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.78 -0.646 . . . . 65.12 110.348 179.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.451 HD21 ' O ' ' A' ' 29' ' ' LEU . 12.9 mt -66.29 -41.04 90.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.047 -0.524 . . . . 74.12 110.722 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.802 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -48.26 -45.56 34.66 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.028 0.442 . . . . 73.21 110.943 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -58.43 -27.29 64.2 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.722 -0.672 . . . . 73.44 110.78 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -112.74 11.88 19.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.207 -0.451 . . . . 73.12 111.124 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.9 mptt 51.22 33.61 9.9 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.85 0.357 . . . . 44.44 110.907 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.785 HD13 HD13 ' A' ' 29' ' ' LEU . 46.7 mt -91.35 -22.62 20.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.104 -0.498 . . . . 73.24 111.802 -179.396 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.802 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -77.37 157.98 30.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.018 0.437 . . . . 63.23 111.123 -179.73 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.73 -121.21 5.1 Favored Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 115.807 -0.633 . . . . 62.11 112.446 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.867 ' O ' HG23 ' A' ' 50' ' ' VAL . 2.2 t-20 -116.32 116.29 27.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.746 0.308 . . . . 72.14 110.914 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.55 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.4 mp -45.74 -55.83 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.24 -0.437 . . . . 63.02 111.413 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -47.61 -37.88 13.45 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.86 -0.609 . . . . 64.41 111.022 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -85.7 -26.08 26.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.022 -0.536 . . . . 65.41 111.089 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.867 HG23 ' O ' ' A' ' 46' ' ' ASN . 23.7 t -81.2 -25.8 10.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 63.21 111.418 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.1 -15.63 63.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.381 -0.372 . . . . 52.41 111.15 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -95.14 -32.96 12.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.235 -0.439 . . . . 73.54 110.86 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -87.94 -29.67 20.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.22 -0.446 . . . . 71.05 111.042 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -96.2 125.55 40.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.301 -0.409 . . . . 63.23 111.1 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -81.2 175.14 10.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 72.2 110.588 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.556 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -57.98 -58.25 9.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.855 0.36 . . . . 75.55 110.552 179.916 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.9 -26.46 68.61 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.075 -0.512 . . . . 65.51 110.584 179.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -62.0 -44.23 97.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.094 0.473 . . . . 74.25 110.441 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.647 HD21 HG12 ' A' ' 26' ' ' ILE . 19.2 mt -71.23 -33.68 70.09 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.635 -0.711 . . . . 75.45 111.046 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.772 HG22 ' HB3' ' A' ' 15' ' ' LEU . 16.4 t -77.38 -42.2 30.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.295 -0.411 . . . . 75.42 110.802 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.4 m -59.61 -34.6 72.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.866 -0.606 . . . . 73.35 110.634 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.485 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -81.96 -21.5 37.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 65.51 111.074 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.813 ' HA ' HD21 ' A' ' 29' ' ' LEU . 11.0 t80 -82.84 -22.89 33.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 74.32 111.029 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -84.37 -53.74 5.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.331 -0.395 . . . . 75.13 111.507 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.458 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.6 p-80 -61.08 -33.09 72.8 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.125 -0.489 . . . . 72.41 111.257 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.691 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.3 tt -47.64 -40.24 19.22 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.962 0.41 . . . . 71.44 111.258 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.406 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.7 m-85 -77.8 -39.02 45.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.029 -0.532 . . . . 75.43 110.679 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -36.28 81.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.92 -0.582 . . . . 63.24 110.988 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.5 p -93.64 -6.65 45.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.147 -0.479 . . . . 71.34 111.475 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.18 36.45 15.81 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.71 0.29 . . . . 72.13 111.186 179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -93.97 44.07 1.12 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.363 -0.381 . . . . 64.13 110.979 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.401 ' HA ' HD21 ' A' ' 66' ' ' LEU . 87.8 m-85 -65.48 174.65 2.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 74.44 110.822 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.2 tttt -70.07 153.07 43.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.274 -0.421 . . . . 63.13 110.906 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -103.15 -85.8 1.9 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.705 -0.759 . . . . 73.41 112.424 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 4.5 m -163.97 157.78 18.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.788 0.328 . . . . 73.03 110.848 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -169.03 -42.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 64.34 110.986 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.764 ' O ' HD13 ' A' ' 78' ' ' ILE . 83.6 p -156.07 179.76 8.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.117 -0.492 . . . . 53.31 111.017 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.764 HD13 ' O ' ' A' ' 77' ' ' SER . 24.8 mm -140.8 135.34 33.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 62.5 111.138 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.3 m -93.47 159.78 15.09 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.239 -0.437 . . . . 71.12 110.886 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -162.63 143.58 9.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 74.11 110.862 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.2 m -126.81 173.46 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 62.1 111.159 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.3 t -104.27 105.16 15.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.451 . . . . 60.13 110.858 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -149.98 151.59 33.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 55.41 110.913 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -152.6 144.23 23.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 75.43 110.954 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -131.7 127.37 58.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 74.14 111.138 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -129.03 -60.89 1.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 62.23 110.891 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -145.71 118.69 8.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 71.32 110.899 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.81 152.55 26.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 72.22 111.109 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.5 tptt -91.23 -33.06 15.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.206 -0.452 . . . . 74.03 110.866 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.5 tp 60.31 102.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.453 . . . . 71.1 110.886 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -106.08 -32.87 8.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 64.34 110.871 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -133.3 152.58 51.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 73.43 110.883 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -98.76 134.89 41.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 63.31 110.9 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 22.8 mtmt -131.76 161.26 63.51 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 73.43 110.926 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -69.89 163.54 37.98 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.553 2.168 . . . . 75.31 112.36 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.51 171.56 4.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 75.41 110.884 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -177.7 -39.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 63.51 110.957 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.0 t -93.44 136.41 33.73 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.09 -0.504 . . . . 54.12 110.895 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.48 147.56 39.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.181 -0.463 . . . . 64.43 110.864 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.4 p -86.33 126.58 34.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 75.23 110.902 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.23 31.52 2.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 71.44 110.91 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -108.36 126.68 53.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 72.11 110.901 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 71.8 p -109.82 143.15 40.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 34.21 110.914 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 7.9 mt -80.05 -179.07 6.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 64.44 110.906 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -112.37 -35.54 5.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 55.25 110.93 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.86 -38.1 3.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.126 -0.488 . . . . 74.11 110.946 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.03 91.7 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.745 -0.74 . . . . 73.04 112.523 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.51 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 32.0 Cg_exo -56.77 -46.07 32.13 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.539 2.16 . . . . 74.54 112.902 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.51 ' CD ' ' N ' ' A' ' 108' ' ' PRO . 90.1 Cg_endo -82.01 -168.12 0.57 Allowed 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 123.007 2.471 . . . . 74.11 112.381 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -140.69 28.82 1.95 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.235 -0.438 . . . . 75.04 110.959 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.485 ' CE2' ' HB2' ' A' ' 178' ' ' ALA . 8.0 p90 -154.34 147.9 25.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.278 -0.419 . . . . 64.31 110.882 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 70.7 m -118.01 103.55 10.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 71.02 110.893 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.61 151.46 21.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.331 -0.395 . . . . 70.43 111.117 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 1.2 m -143.93 124.96 14.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.114 -0.494 . . . . 73.43 110.761 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.601 ' O ' HG13 ' A' ' 115' ' ' VAL . 10.0 p -82.61 108.62 15.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.234 -0.439 . . . . 74.42 111.193 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -84.55 -47.86 10.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 75.32 110.784 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -117.63 107.9 14.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.177 -0.465 . . . . 73.35 110.949 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -62.15 134.35 56.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 65.21 110.917 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -104.52 -160.99 24.13 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.78 -0.724 . . . . 65.24 112.319 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -34.84 -47.33 0.34 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.917 0.389 . . . . 73.25 111.723 -179.411 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.533 ' O ' HG23 ' A' ' 122' ' ' THR . 0.8 OUTLIER 72.44 37.59 0.9 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.945 -0.57 . . . . 74.24 110.484 -179.764 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.533 HG23 ' O ' ' A' ' 121' ' ' LYS . 0.9 OUTLIER -162.08 -44.05 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.921 -0.581 . . . . 73.51 110.758 179.984 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -85.62 97.28 10.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 60.35 110.889 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -112.27 155.21 43.93 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.101 -0.499 . . . . 74.21 110.819 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.753 ' HB2' HG21 ' A' ' 166' ' ' VAL . 63.0 Cg_endo -73.84 125.52 10.0 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.529 2.152 . . . . 74.22 112.57 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -96.07 160.16 14.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.005 -0.543 . . . . 64.3 110.913 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.74 116.12 2.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.234 -0.439 . . . . 70.11 110.981 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . 0.403 ' O ' ' HG2' ' A' ' 165' ' ' LYS . . . 101.08 -28.28 16.74 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.743 -0.742 . . . . 64.43 112.239 -179.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.677 ' O ' HG22 ' A' ' 166' ' ' VAL . 3.9 m-20 -71.68 130.96 42.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.703 0.287 . . . . 73.15 110.4 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' ' 224' ' ' ASP . 12.4 m -73.59 176.17 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.072 0.463 . . . . 74.12 111.423 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.646 HG12 HG23 ' A' ' 223' ' ' ILE . 19.9 m -156.99 146.27 11.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.567 -0.742 . . . . 72.13 110.655 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.418 ' ND1' ' HB3' ' A' ' 163' ' ' SER . 0.5 OUTLIER -124.61 117.27 23.91 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.987 -0.285 . . . . 54.43 110.405 179.275 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.58 ' HB3' HD22 ' A' ' 220' ' ' LEU . 29.7 p -155.38 169.96 23.01 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.075 0.464 . . . . 61.51 111.411 -179.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.621 ' HB3' HD11 ' A' ' 149' ' ' ILE . 60.7 m95 -102.26 160.45 14.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.735 -0.666 . . . . 72.11 110.234 179.369 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.419 ' OH ' HD13 ' A' ' 162' ' ' LEU . 6.1 p90 -158.25 134.64 9.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.977 0.418 . . . . 71.21 111.59 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.866 HG21 HG11 ' A' ' 5' ' ' VAL . 84.8 m -124.84 108.83 12.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.616 . . . . 74.3 110.174 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.644 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -93.76 143.7 16.67 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.594 -0.812 . . . . 73.32 113.38 -179.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.565 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.7 OUTLIER -152.36 134.28 14.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.718 0.294 . . . . 52.42 110.574 179.669 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.438 HD23 HD23 ' A' ' 214' ' ' LEU . 52.9 mt -62.15 -179.73 0.24 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.425 -0.352 . . . . 72.42 110.672 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -54.74 -41.69 70.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.914 0.387 . . . . 64.3 110.836 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -80.68 0.35 34.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.016 -0.538 . . . . 64.03 111.488 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 89.19 25.85 27.66 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.644 -0.789 . . . . 42.12 112.542 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.8 m -80.77 108.34 14.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.828 0.347 . . . . 64.23 110.943 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 38.3 t -63.81 120.45 10.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 41.14 111.102 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.443 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 21.5 p90 -111.61 -24.43 10.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.222 -0.444 . . . . 70.25 111.104 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -162.18 112.63 1.56 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.799 0.333 . . . . 64.44 111.149 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.485 HG22 ' H ' ' A' ' 149' ' ' ILE . 43.5 m -127.01 113.28 16.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 72.54 110.696 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.51 ' C ' HD12 ' A' ' 149' ' ' ILE . 52.5 t30 -87.1 12.64 11.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 74.53 111.66 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.68 ' N ' HD12 ' A' ' 149' ' ' ILE . 2.5 mp -114.13 119.59 61.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.857 0.361 . . . . 75.21 111.003 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -123.57 -48.47 1.93 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 74.51 110.858 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 29.8 p -146.48 166.0 27.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 73.5 110.954 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.3 m -83.31 166.3 18.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 75.2 110.953 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -81.06 -47.28 13.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.439 . . . . 63.42 111.071 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.9 tppt? -60.06 -33.08 71.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 73.23 110.943 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 12.4 tttp -76.54 -31.59 57.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.172 -0.467 . . . . 73.12 110.88 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -173.11 166.35 4.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 65.23 110.916 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 28.3 mttt -98.79 31.27 3.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 75.11 110.896 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -101.26 34.46 2.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 72.24 110.853 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.529 ' HB1' ' HH2' ' A' ' 134' ' ' TRP . . . -157.18 118.43 3.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 73.33 111.034 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 20.1 mttt -132.53 124.32 18.97 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 72.05 110.874 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.401 ' HB2' ' HB3' ' A' ' 132' ' ' HIS . 50.4 Cg_exo -53.98 150.51 30.58 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.493 2.129 . . . . 71.43 112.294 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.419 HD13 ' OH ' ' A' ' 135' ' ' TYR . 0.5 OUTLIER -80.17 128.85 34.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.199 -0.455 . . . . 62.55 110.658 179.909 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.613 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 1.0 OUTLIER -109.45 127.3 54.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.322 -0.399 . . . . 65.55 111.313 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.587 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 25.3 p90 -152.82 143.5 22.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.066 -0.516 . . . . 74.23 110.829 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.603 ' CB ' HG21 ' A' ' 168' ' ' VAL . 2.2 mptt -71.02 132.34 45.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.337 -0.392 . . . . 62.03 110.9 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.753 HG21 ' HB2' ' A' ' 125' ' ' PRO . 33.7 m -87.68 149.26 4.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.142 -0.481 . . . . 64.51 111.06 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.74 24.46 75.47 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.792 -0.718 . . . . 44.4 112.64 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.603 HG21 ' CB ' ' A' ' 165' ' ' LYS . 14.4 m -134.03 46.42 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.845 0.355 . . . . 74.33 111.129 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.28 35.74 2.73 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 121.204 -0.522 . . . . 70.12 113.256 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . 0.58 ' HG2' HG23 ' A' ' 168' ' ' VAL . 12.3 mmtt -81.19 -47.03 13.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.897 0.38 . . . . 74.01 110.952 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . 0.41 HG22 ' CE2' ' A' ' 164' ' ' PHE . 0.3 OUTLIER -118.64 -179.09 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.992 -0.549 . . . . 64.23 110.879 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.57 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.4 pt -57.8 158.85 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.418 -0.355 . . . . 71.12 111.074 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 25.5 ttm105 -67.45 -27.15 66.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.235 -0.439 . . . . 63.23 111.273 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.58 -36.65 37.43 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.679 -0.772 . . . . 70.21 112.188 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.726 ' HE1' HG21 ' A' ' 218' ' ' VAL . 1.9 t90 -77.86 -33.68 52.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.954 0.407 . . . . 72.0 111.014 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -62.27 -41.54 98.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.964 -0.562 . . . . 72.53 110.308 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.94 -29.78 65.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.9 -0.591 . . . . 71.43 110.547 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.646 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -78.7 -61.65 1.94 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 71.41 111.246 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.717 HD21 ' NE1' ' A' ' 175' ' ' TRP . 15.1 mt -58.9 -20.44 51.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.978 -0.556 . . . . 73.41 111.23 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 4.1 mt -60.37 -27.21 67.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.774 0.321 . . . . 73.43 110.883 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 69.9 p -107.78 10.27 28.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 73.41 111.598 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.757 ' SD ' HD23 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -73.35 99.41 2.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.87 0.367 . . . . 63.14 110.848 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.17 161.46 19.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 75.32 111.169 -179.557 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . 0.439 ' HG3' HD12 ' A' ' 223' ' ' ILE . 10.8 tttt -59.88 114.99 3.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.827 -0.624 . . . . 72.41 111.227 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 81.3 8.62 86.97 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.961 -0.638 . . . . 72.33 113.126 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -85.4 139.7 31.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.028 0.442 . . . . 74.1 111.404 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -117.08 139.28 50.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.861 -0.609 . . . . 71.41 109.927 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -148.01 175.39 11.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 33.15 112.061 -179.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.63 121.39 17.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.41 -0.813 . . . . 65.12 109.56 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.646 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.5 pt? -134.36 143.42 47.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.346 0.593 . . . . 50.01 112.351 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.878 ' HG2' HG23 ' A' ' 215' ' ' THR . 4.2 mt-10 -114.87 117.42 30.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.135 -0.939 . . . . 71.44 109.945 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.499 HD12 ' CE2' ' A' ' 216' ' ' PHE . 2.2 mt -108.28 137.15 41.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.972 0.415 . . . . 71.02 111.495 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.63 164.94 45.89 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 70.35 110.57 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . 0.464 ' HG3' ' HA ' ' A' ' 211' ' ' ASN . 19.4 Cg_endo -59.03 -35.24 98.79 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.568 2.179 . . . . 54.45 112.226 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -56.54 -43.53 79.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.238 -0.437 . . . . 45.1 111.411 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.446 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 12.5 m0 -96.64 34.96 1.57 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.884 0.373 . . . . 63.02 111.169 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -159.38 -78.78 0.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.004 -0.544 . . . . 63.02 110.727 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . 0.578 ' CE2' HD13 ' A' ' 208' ' ' ILE . 47.1 m-85 -105.47 -71.28 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.0 0.429 . . . . 64.33 110.401 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.23 178.4 16.43 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.763 -0.732 . . . . 53.41 112.953 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -56.98 -31.7 65.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.811 0.339 . . . . 71.3 110.803 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -53.3 58.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.464 . . . . 75.23 110.609 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 107.61 -147.3 16.35 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.845 -0.693 . . . . 62.42 112.518 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.802 ' CB ' HD12 ' A' ' 208' ' ' ILE . 0.0 OUTLIER -156.61 82.9 3.29 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.779 0.323 . . . . 63.35 110.656 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -51.13 -35.7 52.66 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.749 2.3 . . . . 63.53 112.638 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.7 -42.1 83.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.855 0.359 . . . . 74.45 111.009 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.501 ' HB3' HG13 ' A' ' 208' ' ' ILE . . . -101.77 27.17 6.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.052 -0.522 . . . . 74.35 111.361 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 51.7 31.04 7.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.366 -0.379 . . . . 74.14 111.09 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.802 HD12 ' CB ' ' A' ' 203' ' ' GLN . 24.5 mt -89.17 111.71 46.77 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 51.23 111.181 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . 0.549 ' O ' ' HB2' ' A' ' 212' ' ' ALA . 70.6 Cg_endo -74.5 164.85 33.0 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.451 2.101 . . . . 71.32 112.397 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.99 147.89 50.36 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.651 2.234 . . . . 73.12 112.347 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . 0.464 ' HA ' ' HG3' ' A' ' 194' ' ' PRO . 70.7 m-80 51.13 36.22 15.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 73.12 111.03 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 209' ' ' PRO . . . -82.58 142.14 32.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 43.32 111.978 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -97.24 159.2 15.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.677 -0.692 . . . . 62.43 109.873 179.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.543 HD11 ' CD2' ' A' ' 198' ' ' TYR . 3.0 mt -134.39 108.99 8.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.988 0.423 . . . . 74.43 111.951 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.878 HG23 ' HG2' ' A' ' 191' ' ' GLU . 25.5 m -103.06 139.68 38.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.873 -0.603 . . . . 75.02 110.449 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.644 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 12.4 p90 -158.75 179.27 9.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.097 0.475 . . . . 70.11 111.894 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -136.67 140.32 42.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.543 -0.753 . . . . 71.14 110.593 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.726 HG21 ' HE1' ' A' ' 175' ' ' TRP . 4.4 t -124.12 151.8 29.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.087 0.47 . . . . 62.25 111.986 -178.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.427 ' O ' ' HB2' ' A' ' 133' ' ' CYS . 25.4 tt0 -135.97 109.21 7.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.608 -0.724 . . . . 73.02 110.106 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.757 HD23 ' SD ' ' A' ' 182' ' ' MET . 0.2 OUTLIER -69.71 127.89 34.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.313 -0.403 . . . . 71.04 110.936 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 22.0 t -109.06 -29.46 2.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.167 -0.469 . . . . 63.13 111.33 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -169.59 160.34 8.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.412 -0.358 . . . . 64.25 110.916 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.646 HG23 HG12 ' A' ' 131' ' ' VAL . 3.4 mp -139.24 110.17 4.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 62.14 111.106 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . 0.563 ' O ' HG22 ' A' ' 130' ' ' VAL . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 73.04 110.892 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 mtt . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.856 0.36 . . . . 71.34 111.211 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -108.3 136.93 47.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 75.22 111.121 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -95.24 78.24 3.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 73.0 111.103 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -74.74 170.29 16.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 73.34 111.08 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.957 HG11 HG21 ' A' ' 136' ' ' THR . 24.0 t -65.24 111.77 6.78 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 65.24 111.165 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.449 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.5 Cg_endo -78.4 137.61 15.02 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.608 2.206 . . . . 71.33 112.419 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.402 ' O ' ' N ' ' A' ' 9' ' ' ALA . 7.6 mm-40 -80.2 154.72 27.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.246 -0.433 . . . . 71.41 110.852 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.543 HH11 HD12 ' A' ' 149' ' ' ILE . 0.0 OUTLIER -52.34 89.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.107 -0.497 . . . . 72.45 111.373 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.402 ' N ' ' O ' ' A' ' 7' ' ' GLN . . . -60.69 -34.55 74.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 73.04 111.056 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.427 ' CE2' HD11 ' A' ' 20' ' ' LEU . 1.5 m-90 -116.09 173.74 6.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.125 -0.489 . . . . 72.53 110.965 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.3 m -116.25 152.18 34.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.944 -0.571 . . . . 41.41 110.535 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.55 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.9 t -56.6 -33.64 40.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.912 0.386 . . . . 62.51 110.854 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -74.13 -25.7 59.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.989 -0.55 . . . . 74.21 111.181 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -82.12 -56.91 3.65 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.806 0.336 . . . . 73.44 110.994 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.69 ' HB3' HG22 ' A' ' 60' ' ' VAL . 1.2 mt -49.6 -63.73 1.02 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.258 -0.428 . . . . 61.33 111.116 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.552 ' HG3' HG11 ' A' ' 60' ' ' VAL . 22.5 mtt180 -53.92 -24.72 17.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.484 . . . . 73.43 111.187 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.17 178.23 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.034 0.445 . . . . 72.11 111.256 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -110.41 17.05 21.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.827 -0.624 . . . . 72.22 111.179 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.67 -24.89 11.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.588 -0.278 . . . . 73.44 111.231 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.523 HD22 HD11 ' A' ' 25' ' ' ILE . 6.2 tt -89.07 116.27 65.88 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.414 -0.357 . . . . 74.44 111.054 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.29 124.41 15.81 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.437 2.091 . . . . 60.33 112.235 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.458 ' O ' HD12 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -60.77 -24.18 65.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 64.14 111.206 -179.942 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.2 mmmt -57.75 -32.97 67.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.388 -0.369 . . . . 73.24 111.335 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -78.87 -53.07 7.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.923 0.392 . . . . 62.14 111.133 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.673 ' O ' HD12 ' A' ' 29' ' ' LEU . 34.9 mt -46.54 -35.66 2.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.899 -0.592 . . . . 63.31 111.411 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.692 ' HB ' HG23 ' A' ' 47' ' ' ILE . 6.2 mt -75.74 -44.72 39.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 63.13 111.012 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.78 -25.18 64.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.01 -0.541 . . . . 72.35 110.925 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 32' ' ' HIS . 38.3 t80 -70.05 -44.01 70.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 74.21 110.65 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.729 HD21 ' HA ' ' A' ' 63' ' ' TYR . 2.5 mt -71.32 -24.21 62.08 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.752 -0.658 . . . . 75.2 110.92 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -76.34 -25.15 54.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.282 -0.417 . . . . 71.23 110.803 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -102.35 -10.51 19.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.236 -0.438 . . . . 72.11 111.095 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 28' ' ' PHE . 13.1 m170 -117.09 -11.43 10.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.425 -0.352 . . . . 72.22 111.371 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -120.3 164.69 13.8 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.679 -0.772 . . . . 34.43 112.391 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.77 149.58 21.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.599 0.238 . . . . 73.12 110.468 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.594 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -48.51 -57.15 6.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.79 0.328 . . . . 62.35 111.016 -179.82 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.3 p -47.89 -51.67 22.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.909 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.516 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 4.7 t80 -53.48 -46.85 70.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.835 -0.621 . . . . 62.02 110.387 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.512 HD22 ' HB3' ' A' ' 43' ' ' LEU . 13.2 mt -65.34 -41.47 93.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.0 -0.545 . . . . 71.04 110.744 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.852 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -48.11 -43.64 31.21 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.961 0.41 . . . . 54.21 111.034 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -58.87 -27.96 65.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.905 -0.589 . . . . 63.53 110.834 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 39.1 m-70 -112.75 10.28 19.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.155 -0.475 . . . . 71.32 111.169 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.4 mttp 55.24 36.98 28.2 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.89 0.376 . . . . 53.03 110.823 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.555 HD21 HD23 ' A' ' 59' ' ' LEU . 11.7 mt -94.97 -21.84 18.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.109 -0.496 . . . . 72.33 111.898 -179.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.852 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -77.24 155.51 32.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.12 0.486 . . . . 73.13 111.201 -179.756 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.27 -123.51 5.89 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.626 -0.715 . . . . 71.11 112.427 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.658 ' O ' HG23 ' A' ' 50' ' ' VAL . 2.4 m-80 -116.38 118.04 31.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.75 0.309 . . . . 61.42 110.986 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.692 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.1 mp -45.16 -52.22 2.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.167 -0.47 . . . . 53.35 111.401 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -47.34 -37.16 10.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.907 -0.588 . . . . 52.12 110.974 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -85.65 -25.67 26.45 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.921 -0.581 . . . . 73.24 111.205 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.658 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.5 t -83.45 -25.94 7.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.384 -0.371 . . . . 73.52 111.453 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.78 -17.93 64.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.441 -0.345 . . . . 61.54 111.406 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.6 pttp -95.09 -33.8 12.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.829 0.347 . . . . 73.42 110.995 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.5 m -87.38 -31.0 20.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.228 -0.442 . . . . 60.5 111.031 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.68 127.7 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 63.11 111.17 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -83.41 176.77 8.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 73.42 110.683 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.536 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -58.54 -58.25 9.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.869 0.366 . . . . 72.01 110.515 179.918 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.39 -29.49 70.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.141 -0.481 . . . . 74.54 110.308 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -42.22 98.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 74.41 110.435 179.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.555 HD23 HD21 ' A' ' 43' ' ' LEU . 71.8 mt -72.03 -35.75 69.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.734 -0.666 . . . . 72.22 110.87 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.69 HG22 ' HB3' ' A' ' 15' ' ' LEU . 17.3 t -75.57 -41.24 41.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.213 -0.449 . . . . 72.21 110.826 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.6 m -60.45 -34.0 73.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.895 -0.593 . . . . 52.44 110.428 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.426 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -80.7 -21.24 41.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 72.53 110.932 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.729 ' HA ' HD21 ' A' ' 29' ' ' LEU . 62.1 t80 -83.86 -22.95 31.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.077 -0.51 . . . . 74.44 111.017 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -84.89 -54.51 4.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.23 -0.441 . . . . 73.34 111.512 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.516 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.4 p-80 -61.31 -26.28 67.68 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.076 -0.511 . . . . 75.03 111.056 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.664 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.7 tt -53.08 -39.81 63.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.938 0.399 . . . . 54.24 110.976 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -78.23 -37.66 44.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.981 -0.554 . . . . 74.2 110.599 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.62 -36.51 78.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.974 -0.557 . . . . 64.13 110.818 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 46.6 p -88.9 -9.82 50.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.033 -0.531 . . . . 73.1 111.454 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 50.5 37.69 16.53 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.754 0.312 . . . . 64.25 111.234 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 37.1 mtt180 -100.3 47.54 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.286 -0.416 . . . . 64.05 110.975 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.434 ' CD2' ' HD2' ' A' ' 6' ' ' PRO . 75.1 m-85 -69.22 178.61 2.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.164 -0.471 . . . . 74.23 110.924 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -76.59 132.02 39.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 55.44 110.749 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 179.91 -84.96 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.647 -0.787 . . . . 72.51 112.479 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 26.8 p -57.13 96.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.82 0.343 . . . . 73.02 110.981 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -176.98 -39.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 51.34 110.88 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 68.8 m -160.8 120.11 2.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.116 -0.493 . . . . 72.44 110.927 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.2 mt -103.81 -30.47 2.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.464 . . . . 60.34 111.148 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.1 m -157.27 -45.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 74.14 110.963 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.1 mtpt 61.32 113.82 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.997 -0.547 . . . . 65.43 110.92 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.4 m -123.71 114.58 42.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.457 . . . . 55.24 111.091 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.529 ' HB3' HG23 ' A' ' 85' ' ' VAL . 37.0 m -92.57 172.38 8.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 73.23 110.874 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -107.9 -33.02 7.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 52.52 110.928 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -164.31 96.31 0.77 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 65.13 110.886 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.529 HG23 ' HB3' ' A' ' 82' ' ' SER . 21.6 t -131.12 113.24 23.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 52.33 111.146 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.42 120.68 13.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 52.51 110.921 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -137.94 29.38 2.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 64.44 110.957 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 20.8 t 68.79 -67.99 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.25 -0.432 . . . . 73.11 111.285 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -64.57 98.09 0.24 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.982 -0.554 . . . . 73.02 110.939 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.605 HD23 ' H ' ' A' ' 92' ' ' GLU . 0.5 OUTLIER 61.79 152.02 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 75.33 110.933 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.424 ' N ' HD23 ' A' ' 90' ' ' LEU . 20.2 p-10 -112.78 -34.61 5.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 65.32 110.927 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.605 ' H ' HD23 ' A' ' 90' ' ' LEU . 1.2 tt0 60.4 100.75 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 65.41 110.858 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -111.57 -33.22 6.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.448 . . . . 64.52 110.979 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.4 mmtt -93.49 143.03 25.98 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 62.04 110.939 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.32 132.42 50.63 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.501 2.134 . . . . 64.21 112.269 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 2.2 pttt -177.21 116.06 0.1 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.464 . . . . 63.42 110.89 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -151.25 130.38 12.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 63.11 110.917 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.47 HG23 ' O ' ' A' ' 98' ' ' THR . 8.8 t -150.6 110.32 4.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.175 -0.466 . . . . 74.41 110.882 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.34 137.72 44.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 65.32 110.918 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 43.0 m -140.45 163.64 32.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 41.15 110.919 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.64 106.36 7.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 63.01 110.937 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -160.58 124.57 3.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 73.31 110.899 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 53.8 p -157.5 137.33 12.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 75.13 110.871 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 tt 61.26 113.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 54.24 110.965 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.6 -33.21 11.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 73.43 110.924 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -95.6 89.92 5.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 74.04 110.876 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -127.6 92.5 0.36 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.739 -0.743 . . . . 74.55 112.482 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.513 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 32.1 Cg_exo -56.58 -45.95 33.39 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.54 2.16 . . . . 75.12 112.904 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.513 ' CD ' ' N ' ' A' ' 108' ' ' PRO . 89.5 Cg_endo -81.99 -168.09 0.57 Allowed 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 123.019 2.479 . . . . 75.43 112.389 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.436 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -131.46 30.24 4.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 74.43 110.936 -180.0 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.511 ' CE2' ' HB2' ' A' ' 178' ' ' ALA . 41.4 p90 -151.59 155.08 37.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.273 -0.421 . . . . 61.23 110.931 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 71.5 m -122.88 103.5 8.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.161 -0.472 . . . . 71.21 110.845 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.508 ' CE ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -89.48 151.38 22.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.275 -0.421 . . . . 63.4 111.125 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.426 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.9 OUTLIER -144.89 112.83 6.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 54.25 110.837 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.508 HG22 ' CE ' ' A' ' 113' ' ' LYS . 19.5 t -81.94 106.36 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 72.24 111.29 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.556 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.0 mm? -83.21 -41.81 17.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 72.22 110.844 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 4.6 tptt -128.44 108.13 10.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 73.12 110.984 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -59.44 144.67 46.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 72.02 110.966 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.513 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -115.66 -156.55 11.03 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.721 -0.752 . . . . 52.5 112.642 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -35.84 -52.32 0.72 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.022 0.439 . . . . 62.33 111.576 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.9 tttp 69.9 33.47 2.82 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.834 -0.621 . . . . 64.11 110.325 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -152.33 -44.57 0.1 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.796 -0.638 . . . . 64.21 110.651 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . 0.401 ' HB2' ' HB2' ' A' ' 184' ' ' LYS . 13.7 m120 -91.01 98.41 11.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 74.31 110.841 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -108.08 157.16 36.91 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 71.42 110.913 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.636 ' HA ' HG21 ' A' ' 223' ' ' ILE . 58.7 Cg_endo -71.93 125.83 11.34 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.577 2.185 . . . . 63.24 112.407 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -96.88 155.08 16.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 74.44 110.889 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -62.69 117.12 5.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 70.42 110.861 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 104.78 -22.96 32.43 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.612 -0.804 . . . . 74.34 112.647 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -85.95 140.17 30.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.756 0.312 . . . . 65.2 110.818 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.698 HG12 ' HG3' ' A' ' 165' ' ' LYS . 22.2 m -69.09 173.24 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.971 0.415 . . . . 71.43 111.328 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.901 HG22 ' O ' ' A' ' 164' ' ' PHE . 15.9 m -156.89 145.77 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.717 -0.674 . . . . 62.53 110.588 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.461 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.95 117.89 22.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.659 0.266 . . . . 75.01 110.665 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.434 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 25.1 p -150.28 173.92 13.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.118 0.485 . . . . 71.32 111.407 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.842 ' HB3' HD11 ' A' ' 149' ' ' ILE . 87.5 m95 -108.25 157.58 18.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.552 -0.749 . . . . 72.35 110.057 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.478 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 40.3 p90 -162.23 138.37 7.67 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.223 0.535 . . . . 64.42 112.145 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.957 HG21 HG11 ' A' ' 5' ' ' VAL . 12.3 m -129.69 114.57 16.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.426 -0.806 . . . . 71.04 110.151 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.619 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.06 146.01 18.11 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.544 -0.836 . . . . 54.52 113.328 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.747 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -151.22 147.8 27.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.816 0.341 . . . . 73.2 110.766 179.711 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.484 ' HA ' HD23 ' A' ' 139' ' ' LEU . 12.6 mt -81.72 -177.18 6.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 63.3 110.851 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -59.66 -43.1 94.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.45 . . . . 74.02 110.885 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.04 -5.73 56.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.981 -0.554 . . . . 72.44 111.357 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 98.44 25.42 10.11 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.7 -0.762 . . . . 34.22 112.648 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.08 109.65 20.69 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.827 0.346 . . . . 71.01 110.761 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.498 HG12 HG23 ' A' ' 138' ' ' THR . 3.0 m -63.69 135.1 28.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.446 . . . . 63.32 111.296 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.437 ' CD1' ' N ' ' A' ' 146' ' ' ASP . 21.0 p90 -116.85 -40.99 3.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.094 -0.503 . . . . 53.24 110.643 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . 0.437 ' N ' ' CD1' ' A' ' 145' ' ' PHE . 70.6 m-20 -143.65 110.3 5.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.914 -0.584 . . . . 60.0 110.374 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.427 ' CG2' HG23 ' A' ' 136' ' ' THR . 25.0 m -134.1 107.72 7.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.941 0.401 . . . . 73.23 111.455 -179.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.478 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 27.8 t30 -90.32 44.3 1.19 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.958 -0.565 . . . . 70.14 110.21 179.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.842 HD11 ' HB3' ' A' ' 134' ' ' TRP . 35.5 mm -122.92 105.39 15.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 61.12 110.893 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -95.73 -77.92 0.47 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 71.21 110.938 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 48.6 p -146.49 166.03 27.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 61.33 110.937 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 40.4 m -78.24 139.09 38.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.224 -0.444 . . . . 62.0 110.886 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -67.61 -30.89 70.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.227 -0.442 . . . . 63.41 111.122 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.25 -33.1 71.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 74.24 110.912 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.07 -63.1 1.5 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 72.43 110.943 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 13.0 tttm -138.53 135.57 35.2 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.881 -0.599 . . . . 75.44 110.931 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 8.6 mttm -69.15 93.92 0.64 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.441 . . . . 65.34 110.934 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -176.49 46.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 71.05 110.85 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.09 125.8 5.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 50.04 111.075 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 13.5 mmtt -140.8 145.97 42.12 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 65.53 110.897 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -69.71 152.93 69.68 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.549 2.166 . . . . 51.42 112.31 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.442 HD23 ' HD1' ' A' ' 164' ' ' PHE . 2.0 tt -73.67 123.09 23.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 74.44 110.48 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.682 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.39 120.83 40.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.939 0.4 . . . . 75.43 111.266 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.901 ' O ' HG22 ' A' ' 131' ' ' VAL . 13.9 p90 -149.67 141.13 23.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.029 -0.532 . . . . 74.44 110.786 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.698 ' HG3' HG12 ' A' ' 130' ' ' VAL . 28.2 mtmt -77.34 138.17 39.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.958 0.409 . . . . 72.1 110.895 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.602 HG21 ' HB2' ' A' ' 125' ' ' PRO . 29.8 m -87.5 148.92 4.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.945 -0.57 . . . . 71.45 111.051 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 66.01 25.59 72.11 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.688 -0.768 . . . . 73.23 112.098 -179.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.56 HG21 ' HB3' ' A' ' 165' ' ' LYS . 1.9 t -130.98 40.98 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.843 0.354 . . . . 74.31 111.016 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.54 35.18 5.38 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 121.05 -0.595 . . . . 72.41 112.966 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.31 -47.05 11.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.906 0.384 . . . . 73.05 111.064 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.3 m -117.48 179.73 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.095 -0.502 . . . . 73.21 111.058 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.527 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.7 pt -59.95 160.11 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.332 -0.394 . . . . 61.42 111.12 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -68.04 -28.89 67.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.264 -0.426 . . . . 74.01 111.193 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.83 -37.82 43.6 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.64 -0.79 . . . . 74.14 111.943 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.716 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.3 t90 -79.03 -34.06 44.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.043 0.449 . . . . 65.41 110.964 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . 0.645 ' O ' HD13 ' A' ' 180' ' ' LEU . 36.0 t70 -65.16 -31.16 72.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.756 -0.656 . . . . 74.12 110.602 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -82.0 -28.53 32.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 75.14 110.833 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.628 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -80.32 -62.01 1.81 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.226 -0.443 . . . . 61.31 111.168 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.675 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 6.4 mt -50.29 -32.56 17.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.972 -0.558 . . . . 65.51 110.824 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.645 HD13 ' O ' ' A' ' 176' ' ' ASP . 0.3 OUTLIER -54.54 -24.58 21.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.138 -0.483 . . . . 71.13 110.957 179.734 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 24.9 p -97.54 1.84 49.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.253 -0.431 . . . . 62.4 111.707 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.567 ' HE1' ' O ' ' A' ' 218' ' ' VAL . 0.0 OUTLIER -79.68 152.77 29.75 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.765 0.316 . . . . 64.41 110.565 179.773 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 10.3 p -120.94 173.07 7.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.977 0.418 . . . . 74.5 111.505 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . 0.596 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -64.61 117.4 7.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.808 -0.633 . . . . 74.05 110.574 179.721 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.43 66.46 2.24 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.614 -0.803 . . . . 44.14 112.085 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . 0.513 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 30.9 tt0 -145.05 144.4 30.96 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.623 0.249 . . . . 74.54 110.461 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -119.26 137.24 53.8 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.204 -0.295 . . . . 63.13 110.204 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -144.26 173.1 12.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.149 0.499 . . . . 75.03 111.865 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.57 101.14 4.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.527 -0.761 . . . . 52.44 109.752 179.413 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.807 HD12 HD11 ' A' ' 192' ' ' ILE . 1.0 OUTLIER -115.61 142.26 46.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.123 0.487 . . . . 64.44 111.947 -178.827 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.854 ' HB3' HG23 ' A' ' 215' ' ' THR . 4.8 pt-20 -114.14 119.28 36.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.651 -0.704 . . . . 74.25 110.207 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.807 HD11 HD12 ' A' ' 190' ' ' LEU . 1.8 mm -99.51 143.93 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.858 0.361 . . . . 65.23 111.262 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.42 165.4 46.54 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.075 -0.512 . . . . 71.41 110.602 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -64.51 -43.57 13.32 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.486 2.124 . . . . 72.14 112.264 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -54.67 -24.28 21.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 63.31 111.304 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.436 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 8.5 m0 -115.93 36.94 3.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.404 -0.362 . . . . 75.24 111.122 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -156.67 -81.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.259 -0.428 . . . . 61.42 111.363 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . 0.771 ' CE2' HD13 ' A' ' 208' ' ' ILE . 17.2 m-85 -104.76 -31.19 9.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.899 0.381 . . . . 70.23 110.937 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 107.25 168.42 22.09 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.747 -0.74 . . . . 52.13 112.575 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -30.62 67.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.846 0.355 . . . . 72.11 110.896 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 6.8 pttt -59.91 -48.12 83.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.245 -0.434 . . . . 71.52 110.754 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.68 161.78 24.08 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.801 -0.714 . . . . 74.32 112.467 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.783 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.3 OUTLIER -105.77 89.1 3.27 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 120.65 0.262 . . . . 74.52 110.809 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.37 -22.25 52.83 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.502 2.134 . . . . 64.51 112.369 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.3 -40.51 82.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.304 -0.407 . . . . 62.3 110.923 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -109.26 27.13 9.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 73.44 111.254 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 11.0 tttt 56.84 54.4 7.19 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.249 -0.432 . . . . 74.31 111.044 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.783 HD12 ' HB3' ' A' ' 203' ' ' GLN . 42.4 mt -118.36 111.68 38.13 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.465 . . . . 74.42 111.125 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.37 172.54 1.86 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.516 2.144 . . . . 75.23 112.309 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.2 127.53 12.09 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.583 2.188 . . . . 71.13 112.332 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 30.3 m-20 63.9 71.23 0.49 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.277 -0.419 . . . . 62.43 110.852 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -123.84 128.59 49.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 54.43 111.248 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -65.59 141.37 58.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.477 . . . . 65.11 110.735 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.593 HD11 ' CE2' ' A' ' 198' ' ' TYR . 22.8 mt -121.79 109.61 14.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 74.23 111.117 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.854 HG23 ' HB3' ' A' ' 191' ' ' GLU . 0.2 OUTLIER -107.95 136.83 46.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.36 -0.382 . . . . 72.33 110.778 179.911 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.619 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 18.0 p90 -152.92 176.94 11.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.992 0.425 . . . . 74.5 111.268 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -130.92 135.0 47.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.843 -0.617 . . . . 75.22 110.31 179.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.716 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.6 t -120.24 150.13 22.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.076 0.465 . . . . 63.44 112.122 -178.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -136.75 107.63 6.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.617 -0.72 . . . . 75.41 110.192 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.596 HD22 ' HA ' ' A' ' 184' ' ' LYS . 3.0 tt -70.37 134.47 47.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.38 -0.373 . . . . 73.53 111.046 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.419 ' N ' HD23 ' A' ' 220' ' ' LEU . 20.9 t -111.3 -29.81 2.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.207 -0.451 . . . . 75.03 111.446 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . 0.477 ' N ' HD23 ' A' ' 220' ' ' LEU . 2.0 t0 -173.0 163.87 4.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.855 0.359 . . . . 71.2 111.112 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.682 HG23 HG12 ' A' ' 131' ' ' VAL . 2.7 mp -139.86 110.42 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 73.45 110.984 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . 0.559 ' O ' HG22 ' A' ' 130' ' ' VAL . 1.6 m-20 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 74.13 110.836 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.514 ' HB3' HG21 ' A' ' 75' ' ' THR . 2.1 mpt? . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.846 0.355 . . . . 52.11 111.181 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -174.89 89.21 0.05 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 72.5 111.097 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -73.14 86.89 1.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 62.43 111.107 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.29 142.86 41.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 71.4 111.202 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 1.13 HG11 HG21 ' A' ' 136' ' ' THR . 34.9 t -60.17 110.38 2.8 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.177 -0.465 . . . . 72.52 111.112 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.448 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 85.7 Cg_endo -78.42 142.54 18.75 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.615 2.21 . . . . 41.42 112.512 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.416 ' HB2' ' HB3' ' A' ' 217' ' ' GLU . 7.2 tp60 -83.84 153.48 24.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 71.42 110.833 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.17 110.45 0.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.184 -0.462 . . . . 70.34 111.327 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.56 -18.98 43.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.495 . . . . 64.21 111.2 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.582 ' CD1' HD11 ' A' ' 20' ' ' LEU . 1.4 m-90 -135.01 172.92 12.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.067 0.461 . . . . 62.05 110.761 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.4 m -110.2 148.58 31.56 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.731 -0.668 . . . . 53.15 110.103 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.48 ' O ' ' CG ' ' A' ' 16' ' ' ARG . 58.2 t -56.32 -33.58 38.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.96 0.41 . . . . 74.45 110.211 179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -69.92 -25.74 63.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.803 -0.635 . . . . 72.03 110.791 179.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.417 ' O ' ' HB2' ' A' ' 17' ' ' SER . 0.1 OUTLIER -82.02 -54.9 4.93 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.337 -0.392 . . . . 72.13 111.273 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.795 ' HB3' HG22 ' A' ' 60' ' ' VAL . 4.4 mt -50.0 -66.71 0.35 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.082 0.401 . . . . 51.5 112.082 -178.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.48 ' CG ' ' O ' ' A' ' 12' ' ' VAL . 1.8 ptm180 -61.59 -23.09 65.77 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 120.895 -0.322 . . . . 70.13 111.622 -178.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.417 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -54.61 178.57 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.739 0.304 . . . . 70.41 110.847 179.773 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -110.27 11.39 23.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.326 -0.397 . . . . 73.44 111.434 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -103.47 -26.18 12.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.765 0.317 . . . . 64.14 111.12 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.63 HD22 HD11 ' A' ' 25' ' ' ILE . 8.5 tt -87.53 130.72 46.24 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.348 -0.387 . . . . 74.11 110.91 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -74.25 127.92 11.65 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.505 2.137 . . . . 54.14 112.369 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -25.06 66.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 74.13 111.193 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.54 ' HA ' HD12 ' A' ' 26' ' ' ILE . 11.8 mmtp -54.08 -39.19 66.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.852 0.358 . . . . 72.34 111.351 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.43 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 0.8 OUTLIER -70.05 -58.35 3.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.198 -0.456 . . . . 74.51 111.093 -179.896 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.63 HD11 HD22 ' A' ' 20' ' ' LEU . 17.9 mt -44.7 -32.62 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.864 -0.607 . . . . 62.53 111.577 -179.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.643 HG12 HD21 ' A' ' 59' ' ' LEU . 8.1 mt -75.11 -37.2 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.363 -0.381 . . . . 74.14 111.008 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.8 mttm -72.43 -23.88 61.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.016 -0.538 . . . . 71.41 111.258 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -73.73 -45.88 49.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.967 0.413 . . . . 73.14 110.917 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.915 HD13 HD13 ' A' ' 43' ' ' LEU . 4.6 mt -67.89 -24.96 65.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.862 -0.608 . . . . 74.1 110.998 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -80.46 -27.86 37.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.35 -0.386 . . . . 74.01 110.98 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.42 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 15.7 pt-20 -94.01 -41.63 9.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.298 -0.41 . . . . 63.04 111.034 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.448 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 21.2 m170 -98.51 16.54 21.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.285 -0.416 . . . . 65.12 111.035 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.26 154.37 23.98 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.81 -0.71 . . . . 64.44 112.525 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.1 p -88.6 148.26 24.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.66 0.267 . . . . 72.45 110.653 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.584 ' HA ' HD12 ' A' ' 38' ' ' LEU . 0.5 OUTLIER -48.8 -57.12 6.87 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.784 0.325 . . . . 61.52 110.988 -179.874 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.5 t -48.03 -51.15 25.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.195 -0.457 . . . . 71.53 110.724 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.498 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 17.1 t80 -55.12 -45.55 75.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.759 -0.655 . . . . 75.24 110.16 179.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.656 HD21 ' O ' ' A' ' 29' ' ' LEU . 14.7 mt -63.47 -43.56 96.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.933 -0.576 . . . . 70.43 110.477 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.881 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.5 -34.26 7.29 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.13 -0.487 . . . . 62.12 110.575 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -50.55 -48.36 57.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.65 -0.704 . . . . 51.03 110.76 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -106.36 16.25 25.01 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.947 -0.57 . . . . 74.32 110.883 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.8 mttt 57.27 40.95 27.45 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.833 0.349 . . . . 75.15 110.952 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.915 HD13 HD13 ' A' ' 29' ' ' LEU . 51.0 mt -91.59 -25.38 19.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 34.03 111.597 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.881 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -69.79 158.34 35.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.017 0.437 . . . . 60.4 111.114 -179.761 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.19 -124.77 6.45 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.775 -0.648 . . . . 75.2 112.359 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.834 ' O ' HG23 ' A' ' 50' ' ' VAL . 3.4 m120 -116.39 122.57 45.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.794 0.33 . . . . 61.1 110.88 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.578 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -46.13 -49.4 5.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.219 -0.446 . . . . 73.11 111.29 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.5 mttt -50.75 -39.56 52.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.98 -0.555 . . . . 71.22 110.846 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -85.68 -26.28 26.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.869 -0.605 . . . . 73.3 110.934 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.834 HG23 ' O ' ' A' ' 46' ' ' ASN . 28.5 t -78.8 -25.85 13.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 75.12 111.284 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.56 -19.98 64.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.398 -0.364 . . . . 71.2 111.252 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.1 ptpt -95.06 -33.05 12.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.379 -0.373 . . . . 73.21 110.909 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.83 31.79 2.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 73.52 110.977 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -156.08 125.07 6.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 41.33 111.061 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -84.07 171.7 12.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 65.21 110.722 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.637 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.1 OUTLIER -55.71 -58.08 9.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.917 0.389 . . . . 74.54 110.556 179.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.3 -25.71 67.3 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.036 -0.529 . . . . 44.43 110.537 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -63.32 -46.83 84.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 54.23 110.515 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.643 HD21 HG12 ' A' ' 26' ' ' ILE . 21.9 mt -72.15 -31.18 65.74 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.657 -0.702 . . . . 64.45 111.228 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.795 HG22 ' HB3' ' A' ' 15' ' ' LEU . 15.2 t -79.75 -42.82 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.974 0.416 . . . . 53.31 110.907 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 92.2 m -59.33 -38.02 79.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.941 -0.572 . . . . 73.25 110.774 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.418 ' HA ' ' ND1' ' A' ' 65' ' ' HIS . . . -80.89 -21.81 40.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.314 -0.403 . . . . 65.25 111.108 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.638 ' HA ' HD21 ' A' ' 29' ' ' LEU . 12.9 t80 -82.85 -22.87 33.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 54.43 110.986 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 31.8 m-20 -84.97 -53.62 5.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 45.45 111.583 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.498 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.2 p-80 -61.6 -30.3 70.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.134 -0.485 . . . . 75.23 111.364 -179.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.729 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.1 tt -50.21 -39.83 45.43 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.875 0.369 . . . . 72.03 111.101 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -78.8 -36.79 42.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.065 -0.516 . . . . 64.32 110.598 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.12 -38.16 81.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 73.23 110.843 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 44.8 p -92.73 -6.25 49.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.024 -0.535 . . . . 64.04 111.387 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt 51.55 36.53 17.28 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.768 0.318 . . . . 73.55 111.34 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 41.9 mtt-85 -93.48 44.18 1.13 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.34 -0.391 . . . . 72.21 111.026 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.498 ' HA ' HD21 ' A' ' 66' ' ' LEU . 85.3 m-85 -64.59 173.12 2.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.297 -0.41 . . . . 73.44 110.786 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -62.76 153.03 34.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.273 -0.422 . . . . 72.54 110.9 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.672 ' O ' HG23 ' A' ' 75' ' ' THR . . . -116.32 -111.59 2.71 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.735 -0.745 . . . . 62.11 112.501 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.672 HG23 ' O ' ' A' ' 74' ' ' GLY . 0.7 OUTLIER -170.2 102.19 0.28 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.867 0.365 . . . . 71.4 110.848 179.958 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -111.46 -33.63 6.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.126 -0.488 . . . . 72.5 110.915 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.471 ' O ' HG23 ' A' ' 78' ' ' ILE . 71.0 p -132.97 140.33 47.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.232 -0.44 . . . . 74.44 110.945 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.743 HD12 ' N ' ' A' ' 79' ' ' SER . 2.6 pp -157.47 -44.38 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 73.52 111.212 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.743 ' N ' HD12 ' A' ' 78' ' ' ILE . 22.0 m -92.86 -33.1 14.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.069 -0.514 . . . . 72.13 110.893 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.446 ' O ' HG13 ' A' ' 81' ' ' VAL . 5.0 tttp -92.16 152.22 20.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.452 . . . . 71.15 110.941 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 81' ' ' VAL . 16.8 m -157.08 110.53 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 54.54 111.142 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -177.0 174.87 1.65 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 51.14 110.905 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 63.84 -79.96 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.195 -0.457 . . . . 75.52 111.004 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -90.51 121.54 32.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.152 -0.476 . . . . 72.52 110.912 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.618 HG12 ' H ' ' A' ' 87' ' ' ASN . 19.6 t 64.05 133.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 72.4 111.097 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.1 tttp -97.65 25.58 5.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 73.3 111.125 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.618 ' H ' HG12 ' A' ' 85' ' ' VAL . 2.9 m120 56.74 104.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.339 -0.391 . . . . 73.43 111.086 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.492 HG12 ' H ' ' A' ' 90' ' ' LEU . 20.9 t 63.85 151.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 72.22 111.095 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.62 ' HB3' HD12 ' A' ' 90' ' ' LEU . 4.4 mmmt -86.46 -35.3 19.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 71.21 110.884 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.62 HD12 ' HB3' ' A' ' 89' ' ' LYS . 5.6 mp -147.85 126.59 12.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 70.34 110.903 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -176.88 169.5 2.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.468 . . . . 74.2 110.858 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -81.94 -179.37 7.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 75.44 110.882 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -101.14 120.1 39.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 61.22 110.89 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.94 87.24 40.79 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 51.31 110.886 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.97 168.05 22.96 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.531 2.154 . . . . 74.35 112.281 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? 60.72 104.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 70.22 110.862 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -109.43 -34.1 6.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 73.5 110.914 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.0 t 43.31 68.8 0.46 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.085 -0.507 . . . . 70.54 111.441 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 9.1 tmtt? -60.16 108.21 0.75 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.477 . . . . 74.34 110.863 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.73 -170.16 2.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 73.11 110.898 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -102.42 -31.56 10.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 63.43 110.883 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 60.47 168.95 0.09 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.244 -0.435 . . . . 61.51 110.911 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 37.4 p -111.44 -178.07 3.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 74.22 110.89 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.523 HD23 ' C ' ' A' ' 104' ' ' LEU . 8.5 tt -129.95 117.53 20.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.453 . . . . 73.41 110.861 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -112.06 -34.79 5.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.15 -0.477 . . . . 62.13 110.896 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -96.84 110.77 23.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 74.12 110.889 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 154.7 99.35 0.17 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.65 -0.786 . . . . 70.41 112.476 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.515 ' N ' ' CD ' ' A' ' 109' ' ' PRO . 32.3 Cg_exo -56.4 -46.03 33.23 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.443 2.095 . . . . 71.33 112.839 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . 0.515 ' CD ' ' N ' ' A' ' 108' ' ' PRO . 90.9 Cg_endo -82.11 171.23 12.94 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 123.049 2.499 . . . . 64.32 112.263 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.47 ' CG ' ' CD1' ' A' ' 196' ' ' TRP . 8.4 mmtt -110.41 27.36 9.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 55.13 111.043 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -132.62 151.16 52.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.904 0.383 . . . . 71.32 111.022 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 63.8 m -130.94 103.64 6.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.034 -0.53 . . . . 64.11 111.099 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -101.73 142.31 33.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.331 -0.395 . . . . 74.13 110.978 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.593 ' O ' HD12 ' A' ' 116' ' ' LEU . 1.5 m -140.78 118.0 11.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.477 . . . . 45.0 110.76 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.415 HG12 ' N ' ' A' ' 116' ' ' LEU . 39.7 t -57.65 154.75 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 75.22 111.336 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.593 HD12 ' O ' ' A' ' 114' ' ' SER . 4.1 mp -132.8 -46.59 0.87 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.977 -0.556 . . . . 71.3 110.571 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 17.7 tttm -130.42 108.23 9.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.006 -0.543 . . . . 70.15 110.707 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 20.0 pttt -61.2 131.54 50.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 40.4 110.913 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -100.12 -106.06 2.76 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.713 -0.756 . . . . 74.1 112.345 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.44 -40.21 11.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.916 0.389 . . . . 75.43 110.733 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.9 mtmt 66.75 32.56 6.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.969 -0.56 . . . . 70.12 110.686 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 63.3 m -148.61 -45.14 0.15 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.06 -0.518 . . . . 71.23 110.947 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -91.24 122.24 33.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 54.51 111.0 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -129.07 147.55 65.33 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 75.11 110.88 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.454 ' HA ' HG21 ' A' ' 223' ' ' ILE . 52.6 Cg_exo -52.96 127.4 24.76 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.592 2.195 . . . . 61.41 112.472 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.2 140.66 32.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.182 -0.463 . . . . 74.55 110.777 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.7 mtpt -51.88 113.71 1.08 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.242 -0.436 . . . . 72.21 111.172 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 102.89 -15.14 55.75 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.729 -0.748 . . . . 75.23 112.741 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -88.1 140.95 28.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.826 0.346 . . . . 74.31 111.028 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.588 HG12 ' O ' ' A' ' 224' ' ' ASP . 7.6 p -70.91 163.29 3.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.08 -0.509 . . . . 74.31 110.974 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.933 HG12 HG23 ' A' ' 223' ' ' ILE . 14.0 m -155.21 146.76 13.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 74.2 111.176 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.469 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -127.64 118.0 23.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.711 0.291 . . . . 65.12 110.751 179.705 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.425 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 28.1 p -149.04 166.59 28.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.035 0.445 . . . . 62.24 111.207 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.921 ' HB3' HD11 ' A' ' 149' ' ' ILE . 93.3 m95 -101.8 160.16 14.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.766 -0.652 . . . . 73.15 110.261 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.449 ' CE2' ' ND2' ' A' ' 148' ' ' ASN . 53.1 p90 -163.28 139.48 6.99 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.129 0.49 . . . . 75.21 112.1 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 1.13 HG21 HG11 ' A' ' 5' ' ' VAL . 6.9 m -131.22 116.04 17.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.575 -0.739 . . . . 74.42 110.108 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.572 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -95.65 144.61 17.34 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.661 -0.78 . . . . 43.24 113.443 -179.26 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.633 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -151.75 136.32 16.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.808 0.337 . . . . 74.43 110.411 179.717 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.53 HD21 HD12 ' A' ' 208' ' ' ILE . 31.3 mt -67.81 -178.34 0.94 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 63.24 110.979 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -56.59 -42.1 78.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 75.15 110.89 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.43 -2.48 35.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.976 -0.557 . . . . 74.13 111.504 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . 0.442 ' C ' HG22 ' A' ' 138' ' ' THR . . . 88.57 25.78 29.38 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.664 -0.779 . . . . 50.52 112.672 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 31.0 m -90.61 116.37 28.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.8 0.333 . . . . 72.44 110.816 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.438 HG22 HG23 ' A' ' 138' ' ' THR . 24.1 t -63.61 130.24 28.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 73.52 111.064 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.759 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 55.1 p90 -114.68 -31.06 6.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 63.0 111.106 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . 0.42 ' HB2' ' CD1' ' A' ' 145' ' ' PHE . 2.7 m-20 -168.1 117.5 0.77 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.385 -0.371 . . . . 71.41 111.072 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.552 ' OG1' HG23 ' A' ' 136' ' ' THR . 15.0 t -142.87 129.52 20.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 75.01 110.94 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.449 ' ND2' ' CE2' ' A' ' 135' ' ' TYR . 35.8 p-10 -92.54 50.08 1.56 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.262 -0.426 . . . . 64.35 110.373 179.544 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.921 HD11 ' HB3' ' A' ' 134' ' ' TRP . 19.2 mm -126.95 106.67 15.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.126 -0.488 . . . . 74.3 110.893 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -102.75 -77.31 0.56 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.444 . . . . 61.43 110.975 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 61.8 p -146.53 166.06 27.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 71.33 110.919 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 11.1 m -86.24 159.46 19.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 63.21 110.874 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -66.84 -30.39 70.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 52.32 111.153 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.76 -31.3 69.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 75.43 110.959 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -85.72 -34.38 21.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.235 -0.439 . . . . 75.31 110.907 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 9.2 ttpt -177.3 152.35 0.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 75.43 110.911 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 25.2 mmtt -85.08 76.07 10.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.227 -0.442 . . . . 72.2 110.871 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -154.53 48.35 0.59 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 42.0 110.785 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.2 120.78 4.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 51.13 111.032 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -137.13 133.76 18.61 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 64.11 110.897 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.413 ' HB2' ' HB3' ' A' ' 132' ' ' HIS . 34.5 Cg_exo -56.95 155.94 25.97 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.37 2.047 . . . . 63.25 112.204 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.442 ' O ' HD23 ' A' ' 162' ' ' LEU . 2.6 tt -77.96 119.67 21.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.452 . . . . 73.32 110.382 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.648 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -97.69 121.84 40.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.395 . . . . 75.14 111.384 -179.721 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.881 ' O ' HG22 ' A' ' 131' ' ' VAL . 10.8 p90 -150.36 142.67 24.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.995 -0.548 . . . . 63.45 110.597 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.49 ' HB3' HG21 ' A' ' 168' ' ' VAL . 7.2 mtpt -81.26 141.03 34.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.981 0.42 . . . . 65.04 111.028 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.448 HG11 ' CB ' ' A' ' 125' ' ' PRO . 27.0 m -87.44 149.18 4.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.837 -0.62 . . . . 52.32 111.138 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 66.91 26.28 73.2 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.792 -0.718 . . . . 34.3 112.269 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.49 HG21 ' HB3' ' A' ' 165' ' ' LYS . 2.0 t -131.18 41.19 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.831 0.348 . . . . 75.43 110.984 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.02 34.84 3.23 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 121.105 -0.569 . . . . 73.3 112.966 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.62 -45.8 13.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.885 0.374 . . . . 73.04 111.016 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.1 m -118.41 179.55 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.042 -0.526 . . . . 64.12 111.066 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.537 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -61.82 159.07 2.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.262 -0.426 . . . . 74.43 111.246 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -65.08 -30.16 71.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.158 -0.474 . . . . 72.51 111.292 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -75.8 -36.21 43.04 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.529 -0.843 . . . . 45.44 112.197 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.723 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.5 t90 -80.22 -36.06 35.3 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.914 0.388 . . . . 63.42 110.91 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -60.89 -36.4 79.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.993 -0.549 . . . . 75.4 110.37 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . 0.763 ' O ' HG23 ' A' ' 181' ' ' THR . 3.9 mm-40 -78.04 -29.04 49.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.957 -0.565 . . . . 71.02 110.627 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.654 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -77.71 -60.44 2.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.202 -0.453 . . . . 75.04 111.144 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.669 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 7.1 mt -55.54 -35.98 66.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.984 -0.553 . . . . 50.32 110.897 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 7.7 tp -62.11 -28.77 69.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.224 -0.444 . . . . 70.12 110.835 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . 0.763 HG23 ' O ' ' A' ' 177' ' ' GLU . 37.0 p -89.32 -8.54 53.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 75.14 111.369 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 9.4 mmm -75.47 159.4 31.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.762 0.315 . . . . 75.24 110.829 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.91 166.78 10.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 73.23 111.079 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . 0.716 ' HA ' HD22 ' A' ' 220' ' ' LEU . 5.5 tttm -65.56 123.35 19.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 53.44 111.095 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 70.24 39.27 71.79 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.737 -0.744 . . . . 55.25 112.702 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -121.16 149.78 42.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.834 0.35 . . . . 71.41 110.999 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -116.53 139.29 50.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 63.33 110.226 179.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -147.79 175.84 10.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.058 0.456 . . . . 71.12 111.642 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.7 124.49 21.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.722 -0.672 . . . . 73.23 109.838 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.702 HD11 ' CD1' ' A' ' 175' ' ' TRP . 1.3 pt? -135.91 142.14 44.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.187 0.518 . . . . 74.33 112.152 -179.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.687 ' HG3' HG23 ' A' ' 215' ' ' THR . 0.6 OUTLIER -117.35 113.42 22.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.416 -0.811 . . . . 62.52 110.15 179.302 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.574 HG21 ' O ' ' A' ' 196' ' ' TRP . 4.6 mp -96.57 142.77 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.975 0.417 . . . . 55.42 111.458 -179.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -78.77 164.43 55.51 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 115.88 -0.6 . . . . 73.12 110.834 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.83 -41.43 75.53 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.661 2.241 . . . . 42.04 112.409 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -63.28 -39.0 93.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 71.03 111.162 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.574 ' O ' HG21 ' A' ' 192' ' ' ILE . 9.0 m0 -96.3 27.1 3.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.359 -0.382 . . . . 74.33 111.103 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -150.04 -81.84 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 34.3 110.792 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -104.25 -71.27 0.74 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.039 0.447 . . . . 74.21 110.444 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 145.83 -174.36 25.82 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.823 -0.703 . . . . 72.02 112.808 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -56.9 -40.96 77.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.826 0.346 . . . . 71.23 110.895 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.46 -52.01 65.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.126 -0.488 . . . . 73.52 110.592 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.1 -139.46 14.56 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.84 -0.695 . . . . 63.13 112.519 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.406 ' HA ' ' HD2' ' A' ' 204' ' ' PRO . 2.1 mm-40 -150.89 90.35 4.19 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 120.656 0.265 . . . . 64.42 110.621 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 203' ' ' GLN . 23.8 Cg_endo -61.86 -22.57 74.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.523 2.149 . . . . 72.11 112.668 -179.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.65 -42.18 64.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.86 0.362 . . . . 72.14 110.889 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.759 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -97.59 25.76 5.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.064 -0.516 . . . . 74.22 111.358 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 54.71 32.45 17.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.344 -0.389 . . . . 63.34 111.16 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.53 HD12 HD21 ' A' ' 139' ' ' LEU . 20.2 mm -95.72 111.79 56.96 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 73.44 111.118 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . 0.788 ' HG2' ' HB2' ' A' ' 212' ' ' ALA . 39.9 Cg_endo -67.23 171.46 11.48 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.34 2.027 . . . . 75.1 112.171 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -68.72 122.17 9.1 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.535 2.157 . . . . 53.44 112.314 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 71.42 34.47 1.7 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.214 -0.448 . . . . 75.04 110.988 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . 0.788 ' HB2' ' HG2' ' A' ' 209' ' ' PRO . . . -83.86 147.38 27.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.046 0.45 . . . . 65.31 111.768 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . 0.453 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.1 OUTLIER -88.62 148.05 24.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.776 -0.647 . . . . 53.02 110.367 179.473 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.453 HD23 ' O ' ' A' ' 213' ' ' LYS . 5.5 mt -130.03 109.11 10.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.883 0.373 . . . . 63.54 111.767 -179.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.687 HG23 ' HG3' ' A' ' 191' ' ' GLU . 50.3 m -111.3 141.45 44.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.109 -0.496 . . . . 70.13 110.612 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.572 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 11.6 p90 -153.96 178.17 10.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.107 0.48 . . . . 70.23 111.717 -179.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . 0.462 ' OE2' HD22 ' A' ' 116' ' ' LEU . 1.4 mt-10 -127.9 132.13 49.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.604 -0.725 . . . . 63.3 110.123 179.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.723 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.4 t -120.8 149.04 23.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.121 0.486 . . . . 64.45 112.034 -178.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -136.73 109.85 7.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.584 -0.734 . . . . 75.14 110.253 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.778 HD21 HG13 ' A' ' 223' ' ' ILE . 3.2 tt -69.92 134.33 48.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.342 -0.39 . . . . 71.14 110.89 -179.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.441 ' N ' HD23 ' A' ' 220' ' ' LEU . 40.4 t -112.08 -29.96 2.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.252 -0.431 . . . . 50.14 111.392 -179.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . 0.455 ' N ' HD23 ' A' ' 220' ' ' LEU . 13.4 t70 -168.82 158.71 9.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.821 0.343 . . . . 62.31 111.176 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.933 HG23 HG12 ' A' ' 131' ' ' VAL . 35.1 mt -141.62 111.53 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 72.53 111.168 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . 0.588 ' O ' HG12 ' A' ' 130' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 75.31 110.841 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.823 0.344 . . . . 74.14 111.157 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -175.23 124.53 0.24 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.179 -0.464 . . . . 52.21 111.06 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.36 30.4 2.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.476 . . . . 75.01 111.155 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.75 154.65 41.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 54.55 111.078 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.511 HG23 ' OG1' ' A' ' 138' ' ' THR . 60.5 t -60.05 110.5 2.88 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.183 -0.462 . . . . 71.21 111.086 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.414 ' HD2' ' CE1' ' A' ' 72' ' ' PHE . 90.2 Cg_endo -80.7 146.15 16.59 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.813 2.342 . . . . 62.31 112.469 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.458 ' OE1' HD11 ' A' ' 149' ' ' ILE . 3.2 tp-100 -84.34 152.21 24.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 75.22 110.743 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 mpp_? -52.4 121.31 6.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 65.03 111.116 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -93.78 -13.05 27.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 72.22 111.376 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.631 ' NE1' HD11 ' A' ' 20' ' ' LEU . 1.2 m-90 -137.12 173.73 11.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.877 0.37 . . . . 74.24 110.681 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.7 m -117.11 151.36 36.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.06 -0.518 . . . . 70.33 110.58 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.522 HG12 ' HD2' ' A' ' 16' ' ' ARG . 21.4 t -57.18 -33.17 42.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.065 0.46 . . . . 65.03 110.364 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.53 -28.25 61.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.696 -0.684 . . . . 74.44 111.058 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -82.06 -57.75 3.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.323 -0.399 . . . . 74.41 110.994 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.756 ' HB3' HG22 ' A' ' 60' ' ' VAL . 2.5 mt -50.32 -62.24 1.7 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.198 -0.456 . . . . 64.43 111.092 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.531 ' HG3' HG11 ' A' ' 60' ' ' VAL . 26.0 mtt180 -54.37 -24.35 19.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 65.3 111.268 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.98 173.69 0.31 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.334 -0.394 . . . . 45.51 111.082 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -110.32 16.35 21.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 64.43 111.237 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -107.73 -25.32 11.33 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.547 -0.297 . . . . 74.42 111.011 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.941 HD22 HD11 ' A' ' 25' ' ' ILE . 10.3 tt -86.13 129.48 53.69 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.293 -0.412 . . . . 73.21 110.874 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.29 123.14 9.65 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.332 2.021 . . . . 43.34 112.32 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -24.06 66.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 74.24 111.211 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.9 mmtp -53.38 -39.31 64.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.396 -0.365 . . . . 61.44 111.396 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -79.02 -29.04 43.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.324 -0.398 . . . . 73.4 111.209 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.941 HD11 HD22 ' A' ' 20' ' ' LEU . 49.0 mt -66.18 -37.12 79.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.32 -0.4 . . . . 55.1 111.096 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.702 HG12 HD21 ' A' ' 59' ' ' LEU . 10.3 mt -72.53 -44.47 61.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 73.11 110.938 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.417 ' HG3' HD11 ' A' ' 47' ' ' ILE . 1.2 mtpt -59.53 -24.17 63.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.847 -0.615 . . . . 71.32 111.026 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -74.87 -50.08 18.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 73.21 110.894 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.898 HD23 HD12 ' A' ' 66' ' ' LEU . 5.1 mt -65.13 -40.69 94.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.963 -0.562 . . . . 70.53 110.919 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -67.89 -23.73 65.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.219 -0.446 . . . . 41.04 110.492 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -88.03 -48.21 7.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.086 -0.506 . . . . 75.55 110.885 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -97.23 16.44 19.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 63.05 111.307 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -131.34 151.93 19.86 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.661 -0.781 . . . . 62.1 112.408 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.83 154.05 19.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.685 0.279 . . . . 73.04 110.618 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.541 ' O ' HD21 ' A' ' 44' ' ' LEU . 0.7 OUTLIER -46.98 -52.67 14.14 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.527 -0.306 . . . . 55.14 111.337 -179.806 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 57.8 m -53.01 -46.54 68.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.012 0.434 . . . . 42.01 110.68 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.455 ' CZ ' ' HG ' ' A' ' 66' ' ' LEU . 11.2 t80 -56.6 -48.25 77.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.785 -0.643 . . . . 54.31 110.726 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.718 HD22 ' HB3' ' A' ' 43' ' ' LEU . 13.4 mt -63.46 -45.2 91.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 74.3 110.889 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.929 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -48.07 -34.01 8.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 71.2 111.155 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -59.22 -55.39 35.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.996 -0.547 . . . . 55.11 111.025 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 -95.59 15.29 20.25 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.175 -0.466 . . . . 75.11 111.411 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 mttp 60.08 38.24 20.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.736 0.303 . . . . 71.22 111.182 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.718 ' HB3' HD22 ' A' ' 38' ' ' LEU . 14.3 mt -85.12 -21.76 29.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.373 -0.376 . . . . 62.3 110.796 179.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.929 HD11 ' HB2' ' A' ' 39' ' ' ALA . 81.2 mt -47.08 170.82 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.175 -0.466 . . . . 63.31 111.344 179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.71 -148.95 20.2 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.913 -0.661 . . . . 52.32 112.869 179.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.824 ' O ' HG23 ' A' ' 50' ' ' VAL . 4.6 m-20 -114.85 149.16 37.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.005 0.431 . . . . 73.52 111.16 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.699 HG23 HD12 ' A' ' 26' ' ' ILE . 3.4 mp -45.62 -42.03 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.847 -0.615 . . . . 55.31 111.599 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.21 -43.45 82.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.961 -0.563 . . . . 75.13 111.198 -179.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -85.71 -27.1 25.51 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.076 -0.511 . . . . 74.45 111.292 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 46' ' ' ASN . 35.3 t -76.74 -26.2 16.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.386 -0.37 . . . . 73.13 111.441 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.78 -25.39 65.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.442 -0.344 . . . . 33.2 111.366 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -95.29 -30.54 13.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 73.44 111.103 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -84.05 -19.76 33.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.264 -0.426 . . . . 42.52 111.471 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -117.74 130.13 56.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.865 0.364 . . . . 74.51 111.32 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -78.65 -179.09 6.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 73.01 110.48 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.571 ' O ' HG23 ' A' ' 60' ' ' VAL . 2.5 tpmp? -61.4 -58.45 8.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.796 0.332 . . . . 73.13 110.524 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -25.51 67.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.196 -0.456 . . . . 75.44 110.646 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.04 -40.06 94.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.11 0.481 . . . . 73.25 110.214 179.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.702 HD21 HG12 ' A' ' 26' ' ' ILE . 15.3 mt -77.07 -30.14 55.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.619 -0.719 . . . . 73.22 111.013 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.756 HG22 ' HB3' ' A' ' 15' ' ' LEU . 17.3 t -79.66 -43.48 23.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.991 0.424 . . . . 75.32 110.737 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 63.7 m -59.32 -34.8 72.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.945 -0.571 . . . . 61.5 110.448 179.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.446 ' CB ' HD11 ' A' ' 43' ' ' LEU . . . -82.64 -21.19 35.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.544 . . . . 72.01 110.997 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.78 ' HA ' HD21 ' A' ' 29' ' ' LEU . 14.2 t80 -83.63 -22.64 32.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.094 -0.503 . . . . 74.43 110.918 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 30.2 m-20 -85.06 -53.88 4.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 73.44 111.401 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.428 ' CE1' ' CE1' ' A' ' 37' ' ' PHE . 2.8 p-80 -62.33 -27.27 68.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.097 -0.501 . . . . 73.44 111.323 -179.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.898 HD12 HD23 ' A' ' 29' ' ' LEU . 3.8 tt -50.82 -40.79 56.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.899 0.38 . . . . 63.3 111.065 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.405 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.6 m-85 -79.05 -40.06 32.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.035 -0.53 . . . . 74.02 110.679 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -64.88 -39.75 94.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.961 -0.563 . . . . 74.32 110.972 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 47.2 p -88.98 -10.38 47.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.001 -0.545 . . . . 61.23 111.399 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt 53.55 33.21 15.77 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.683 0.277 . . . . 60.32 111.21 179.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -92.42 45.84 1.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 75.32 111.026 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.476 ' CE1' HD22 ' A' ' 66' ' ' LEU . 94.5 m-85 -64.86 171.87 3.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 62.4 110.801 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 33.9 tttt -62.87 150.91 40.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.325 -0.398 . . . . 73.31 110.914 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -91.09 -137.28 7.21 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.696 -0.764 . . . . 43.22 112.455 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -115.04 -38.47 3.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.906 0.384 . . . . 73.13 110.93 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 58.57 75.46 0.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.102 -0.499 . . . . 74.34 110.916 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.531 ' O ' HG23 ' A' ' 78' ' ' ILE . 1.4 t 60.42 158.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 62.33 110.926 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.531 HG23 ' O ' ' A' ' 77' ' ' SER . 4.1 pt -158.73 145.15 7.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 75.01 111.11 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 34.3 p -67.01 135.62 54.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 64.41 110.896 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.15 30.96 3.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 72.53 110.91 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.4 t 62.1 116.58 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 74.45 111.149 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -129.97 149.35 51.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 71.21 110.875 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -128.79 -49.71 1.24 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 65.2 110.89 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -141.76 125.65 17.12 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.923 -0.58 . . . . 74.41 110.892 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -110.13 -32.35 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.443 . . . . 54.51 111.123 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.41 179.43 4.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 72.12 110.91 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.462 ' O ' HG12 ' A' ' 88' ' ' VAL . 1.9 t-20 -135.44 169.15 17.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 72.01 110.857 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.604 HG22 ' O ' ' A' ' 88' ' ' VAL . 12.7 p 43.82 35.26 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-N 116.073 -0.512 . . . . 61.23 111.595 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.692 ' O ' HD22 ' A' ' 90' ' ' LEU . 3.0 tttm -132.63 -45.49 0.89 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.126 -0.488 . . . . 35.52 110.969 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.692 HD22 ' O ' ' A' ' 89' ' ' LYS . 4.6 mm? -129.76 134.66 47.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.089 -0.505 . . . . 70.4 110.894 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -107.47 -33.12 7.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.255 -0.43 . . . . 65.0 110.947 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 60.64 157.71 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.187 -0.46 . . . . 74.34 110.911 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -110.9 -33.57 6.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.223 -0.444 . . . . 55.43 110.919 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -173.84 86.97 0.36 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 73.02 110.892 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.95 139.06 38.66 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.616 2.21 . . . . 65.55 112.306 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -142.85 123.64 14.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.262 -0.426 . . . . 72.15 110.894 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -143.49 142.87 31.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 74.1 110.875 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 20.7 p -138.04 130.31 29.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 74.43 110.969 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.99 139.93 36.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 72.0 110.892 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.3 m -126.84 159.4 34.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 73.04 110.9 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -104.62 -32.97 8.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 73.45 110.899 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -95.23 152.51 18.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.187 -0.461 . . . . 42.22 110.941 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 58.5 p -94.16 -33.56 13.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 74.41 110.922 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 59.89 96.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 73.11 110.916 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -107.57 -36.81 6.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 73.44 110.907 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -165.12 -43.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.094 -0.503 . . . . 61.35 111.02 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 133.58 69.49 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.792 -0.718 . . . . 40.21 112.512 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.82 176.47 6.77 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.584 2.19 . . . . 50.34 112.313 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -57.41 -159.49 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.671 2.247 . . . . 75.24 112.289 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.442 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -97.24 28.03 3.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 73.41 111.048 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.476 ' CE1' ' HB2' ' A' ' 178' ' ' ALA . 29.5 p90 -152.64 151.61 30.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.295 -0.412 . . . . 73.33 110.848 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 74.1 m -122.14 103.54 8.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 72.04 110.857 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.9 ttpt -95.92 145.52 25.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.328 -0.397 . . . . 73.1 111.11 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.428 ' O ' HD22 ' A' ' 116' ' ' LEU . 1.7 m -138.35 117.78 12.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 34.45 110.727 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 22.8 t -81.07 106.36 12.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.294 -0.412 . . . . 44.34 111.267 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.533 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -82.23 -42.0 19.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 74.32 110.67 179.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -125.05 107.72 11.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 53.4 110.927 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.1 mtmp? -63.64 139.29 58.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 62.35 110.953 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -112.67 -155.02 12.09 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.779 -0.724 . . . . 64.22 112.279 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -33.59 -50.46 0.34 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.917 0.389 . . . . 62.35 111.705 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.1 tttt 71.65 35.64 1.39 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.028 -0.533 . . . . 63.32 110.177 -179.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 75.0 m -163.62 -43.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.664 -0.698 . . . . 71.34 110.525 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -85.3 88.63 7.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.048 -0.524 . . . . 65.02 110.713 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -104.6 155.14 37.85 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 72.41 110.763 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.643 ' HB2' HG21 ' A' ' 166' ' ' VAL . 51.6 Cg_endo -69.49 125.55 12.41 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.433 2.089 . . . . 54.22 112.436 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -95.46 152.29 18.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.007 -0.542 . . . . 63.52 110.9 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.99 116.95 3.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.278 -0.419 . . . . 51.23 110.981 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 100.59 -26.99 22.52 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.73 -0.748 . . . . 75.33 112.519 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -73.13 137.62 45.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.835 0.35 . . . . 53.12 110.905 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.679 HG23 ' HG3' ' A' ' 165' ' ' LYS . 1.2 t -71.16 163.65 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 74.14 110.944 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.728 HG22 ' O ' ' A' ' 164' ' ' PHE . 2.8 m -153.77 145.27 14.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.038 -0.528 . . . . 73.13 110.884 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.449 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.3 OUTLIER -127.18 117.72 22.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.708 0.289 . . . . 75.13 110.658 179.591 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.738 ' HB3' HD22 ' A' ' 220' ' ' LEU . 28.4 p -153.23 167.64 28.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.965 0.412 . . . . 52.23 111.15 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.629 ' O ' HG13 ' A' ' 218' ' ' VAL . 8.4 m95 -102.64 162.98 12.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.928 -0.578 . . . . 73.22 110.067 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.673 ' CE1' HD13 ' A' ' 162' ' ' LEU . 46.3 p90 -162.3 138.4 7.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.078 0.466 . . . . 74.34 111.667 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.85 HG23 ' OG1' ' A' ' 147' ' ' THR . 0.2 OUTLIER -127.49 112.64 15.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.674 -0.694 . . . . 63.4 110.477 179.674 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.608 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.5 143.7 16.87 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.619 -0.801 . . . . 60.02 113.001 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.621 HG23 ' CG1' ' A' ' 144' ' ' VAL . 0.1 OUTLIER -151.47 139.01 19.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.758 0.313 . . . . 73.54 110.539 179.653 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.744 HD21 HG23 ' A' ' 208' ' ' ILE . 70.8 mt -72.0 -178.58 2.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.288 -0.415 . . . . 63.33 111.031 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -58.3 -42.32 86.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 71.24 110.752 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.87 -4.41 40.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.927 -0.579 . . . . 73.04 111.418 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . 0.583 ' C ' HG22 ' A' ' 138' ' ' THR . . . 90.68 21.73 36.04 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.674 -0.774 . . . . 72.14 112.726 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -90.66 109.12 20.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.8 0.333 . . . . 51.02 110.686 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.621 ' CG1' HG23 ' A' ' 138' ' ' THR . 3.1 m -63.58 139.93 20.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 44.32 111.165 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 33.7 p90 -118.85 -40.53 2.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.055 -0.52 . . . . 64.04 111.071 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -155.17 119.98 4.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.074 -0.512 . . . . 61.54 110.727 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.85 ' OG1' HG23 ' A' ' 136' ' ' THR . 3.5 t -142.82 129.39 20.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.279 -0.419 . . . . 73.44 111.327 -179.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.483 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 26.3 t30 -93.62 46.65 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 72.41 110.435 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.551 HD13 ' HB3' ' A' ' 134' ' ' TRP . 17.6 mm -113.29 89.36 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.923 -0.581 . . . . 62.21 110.905 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -81.4 -173.49 4.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 62.32 110.877 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . 0.56 ' O ' ' HB2' ' A' ' 159' ' ' ALA . 41.8 p -64.82 165.95 9.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.126 -0.488 . . . . 55.15 110.927 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 11.3 p -69.73 158.04 36.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 52.32 110.943 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -78.54 -28.37 46.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 73.34 111.165 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.1 tptm -57.62 -28.94 64.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.212 -0.449 . . . . 73.23 111.032 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 9.7 mmtm -58.86 -63.14 1.4 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.955 0.407 . . . . 72.41 110.918 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -166.92 32.03 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.912 -0.585 . . . . 73.24 110.935 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 22.6 mttt 56.22 75.62 0.33 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 64.33 110.981 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -140.64 50.4 1.67 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 73.32 110.89 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.616 ' HB1' ' HH2' ' A' ' 134' ' ' TRP . . . -149.08 125.19 10.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 50.41 111.129 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 5.7 tttm -138.69 120.36 10.26 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 74.21 110.863 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.418 ' HG3' ' CE2' ' A' ' 134' ' ' TRP . 43.7 Cg_exo -56.33 150.96 47.11 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.378 2.052 . . . . 64.03 112.28 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.673 HD13 ' CE1' ' A' ' 135' ' ' TYR . 5.5 tt -74.17 121.73 21.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 63.03 110.563 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.563 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.1 OUTLIER -99.29 120.36 39.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.94 0.4 . . . . 72.23 111.11 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.728 ' O ' HG22 ' A' ' 131' ' ' VAL . 6.4 p90 -148.47 140.66 24.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.045 -0.525 . . . . 65.53 110.455 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.679 ' HG3' HG23 ' A' ' 130' ' ' VAL . 82.3 mttt -80.19 139.1 36.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.066 0.46 . . . . 74.22 111.192 -179.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.643 HG21 ' HB2' ' A' ' 125' ' ' PRO . 34.8 m -87.77 149.17 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.738 -0.664 . . . . 73.13 111.16 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 71.53 21.92 78.68 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.831 -0.7 . . . . 65.0 112.822 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.751 HG23 ' HG3' ' A' ' 170' ' ' LYS . 16.0 m -128.0 41.68 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.881 0.372 . . . . 74.21 111.18 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 41.21 38.19 1.8 Allowed Glycine 0 C--N 1.332 0.356 0 CA-C-N 115.975 -0.557 . . . . 71.15 113.403 179.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . 0.751 ' HG3' HG23 ' A' ' 168' ' ' VAL . 6.8 mtpp -87.38 -39.95 14.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.807 0.337 . . . . 44.42 111.077 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.5 m -119.03 177.13 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.205 -0.452 . . . . 75.12 110.925 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.531 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.6 pt -58.42 158.6 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.339 -0.391 . . . . 73.13 111.331 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -67.34 -26.75 66.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.096 -0.502 . . . . 65.12 111.072 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -76.46 -37.07 36.77 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.615 -0.802 . . . . 73.12 112.087 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.668 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.5 t90 -78.2 -33.72 49.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.965 0.412 . . . . 75.32 111.044 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . 0.484 ' O ' HD13 ' A' ' 180' ' ' LEU . 4.3 t70 -64.65 -36.56 84.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.99 -0.55 . . . . 74.11 110.525 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -75.5 -29.58 59.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.025 -0.534 . . . . 73.4 110.648 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.672 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -81.46 -46.5 14.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 63.13 111.125 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.577 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 10.6 mt -70.67 -18.97 62.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.977 -0.556 . . . . 73.24 111.117 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.484 HD13 ' O ' ' A' ' 176' ' ' ASP . 2.2 tp -55.31 -23.06 21.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.453 -0.34 . . . . 72.13 111.453 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 27.0 p -115.95 19.92 14.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.588 -0.278 . . . . 71.03 111.565 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 2.2 mmt -66.17 108.15 2.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.843 0.354 . . . . 71.43 110.89 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -74.78 145.23 43.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 73.53 110.853 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.67 115.53 2.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 73.3 111.191 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 76.61 21.88 73.8 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.967 -0.635 . . . . 73.33 113.002 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -98.38 144.56 27.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.875 0.369 . . . . 71.33 111.201 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 10.6 ttpt -117.1 139.09 51.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.04 -0.527 . . . . 73.22 110.077 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.64 174.34 11.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.177 0.513 . . . . 62.11 112.0 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.54 107.35 6.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.478 -0.783 . . . . 74.31 109.701 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.672 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.0 OUTLIER -120.16 142.06 49.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.184 0.516 . . . . 63.03 112.105 -178.855 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.629 ' HG3' HG23 ' A' ' 215' ' ' THR . 0.3 OUTLIER -114.32 119.72 37.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.54 -0.755 . . . . 73.11 110.112 179.272 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.521 ' N ' HD13 ' A' ' 192' ' ' ILE . 0.9 OUTLIER -98.26 151.29 4.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.911 0.386 . . . . 74.31 111.173 -179.593 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -86.76 165.14 34.0 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.518 . . . . 63.31 110.715 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -62.12 -42.19 31.0 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.492 2.128 . . . . 73.12 112.246 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -59.0 -39.0 80.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.265 -0.425 . . . . 63.14 111.066 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.442 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 8.9 m0 -97.6 36.94 1.43 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.324 -0.398 . . . . 65.21 110.985 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -162.75 -77.55 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.444 . . . . 44.1 110.749 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . 0.746 ' CE2' HD13 ' A' ' 208' ' ' ILE . 23.0 m-85 -105.12 -71.22 0.75 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 72.0 110.516 179.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.21 175.46 14.1 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.873 -0.68 . . . . 62.4 112.845 179.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -26.38 63.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.782 0.325 . . . . 74.44 110.983 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -67.43 -52.61 37.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.976 0.417 . . . . 71.22 110.776 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 102.33 168.33 26.79 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.87 -0.681 . . . . 73.51 112.515 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.509 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.5 OUTLIER -107.43 91.63 7.26 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.657 0.265 . . . . 73.11 110.791 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -66.95 -21.03 50.51 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.462 2.108 . . . . 61.35 112.477 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.05 -42.05 98.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.873 0.368 . . . . 72.21 110.949 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -105.92 31.18 5.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.102 -0.499 . . . . 72.32 111.15 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 30.9 mttt 54.33 28.28 9.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 74.02 111.039 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.746 HD13 ' CE2' ' A' ' 198' ' ' TYR . 60.1 mt -89.07 113.55 56.64 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 73.41 110.966 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.26 171.5 11.45 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.447 2.098 . . . . 52.44 112.458 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.44 152.62 70.99 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.606 2.204 . . . . 74.51 112.378 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 46.4 32.14 1.48 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.19 -0.459 . . . . 74.41 111.228 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -79.9 144.29 33.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 63.51 111.483 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . 0.619 ' O ' HD23 ' A' ' 214' ' ' LEU . 18.5 tttt -89.55 144.72 25.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.938 -0.574 . . . . 74.31 110.258 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.631 HD11 ' CE2' ' A' ' 198' ' ' TYR . 8.0 mt -127.0 108.88 11.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.876 0.369 . . . . 62.41 111.7 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.629 HG23 ' HG3' ' A' ' 191' ' ' GLU . 56.2 m -109.67 143.18 39.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 52.43 110.501 179.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.608 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 15.0 p90 -156.05 178.38 10.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.108 0.48 . . . . 65.22 111.336 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -134.3 137.71 44.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.667 -0.697 . . . . 71.32 110.314 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.668 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.1 t -123.71 151.95 28.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.018 0.437 . . . . 73.04 111.876 -178.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -136.74 110.42 8.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.793 -0.639 . . . . 74.45 110.27 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.738 HD22 ' HB3' ' A' ' 133' ' ' CYS . 0.2 OUTLIER -69.47 132.81 46.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.426 -0.352 . . . . 74.44 110.758 -179.584 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.499 HG21 ' HE1' ' A' ' 134' ' ' TRP . 20.6 t -111.11 -31.45 2.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.279 -0.419 . . . . 64.42 111.469 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -170.66 161.97 7.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.904 0.383 . . . . 63.13 110.983 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.546 HG23 HG12 ' A' ' 131' ' ' VAL . 4.2 mp -139.48 109.61 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 72.55 111.058 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 75.0 110.906 179.977 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 ttt . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.816 0.341 . . . . 71.14 111.195 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -140.29 82.1 1.84 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 64.14 111.098 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -161.31 78.54 0.57 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.467 . . . . 54.31 111.092 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.31 152.38 43.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 72.21 111.086 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.849 HG11 HG21 ' A' ' 136' ' ' THR . 57.3 t -60.02 109.83 2.32 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.487 . . . . 65.11 111.062 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.457 ' HA ' ' HG2' ' A' ' 217' ' ' GLU . 98.3 Cg_endo -85.92 149.78 9.65 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 123.007 2.471 . . . . 71.13 112.552 -179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.443 ' NE2' HD11 ' A' ' 149' ' ' ILE . 0.8 OUTLIER -84.43 147.2 27.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 43.21 110.972 -179.953 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.28 99.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 73.31 111.234 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.42 -18.35 61.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 51.34 111.268 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.431 ' CH2' ' HB3' ' A' ' 24' ' ' ASP . 2.2 m-90 -131.81 173.35 11.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.865 0.364 . . . . 71.04 110.737 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.74 153.64 27.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.108 -0.496 . . . . 74.44 110.452 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.681 HG21 ' CB ' ' A' ' 152' ' ' SER . 33.6 t -54.75 -35.01 31.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.983 0.42 . . . . 75.45 110.817 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.44 -34.32 78.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.985 -0.552 . . . . 64.12 111.069 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.457 ' HG2' HD12 ' A' ' 20' ' ' LEU . 0.8 OUTLIER -78.5 -55.43 5.22 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.798 0.332 . . . . 73.24 111.044 -179.902 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.709 ' HB3' HG22 ' A' ' 60' ' ' VAL . 8.2 mt -50.7 -30.76 14.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.993 0.425 . . . . 74.04 110.855 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.613 ' HD2' HG12 ' A' ' 12' ' ' VAL . 47.7 mtt180 -90.95 -28.77 17.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.829 -0.623 . . . . 75.31 110.397 179.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 31.0 t -49.37 176.0 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.901 -0.591 . . . . 74.24 111.484 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -110.37 17.41 20.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.746 -0.661 . . . . 74.41 111.234 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -117.67 -16.45 10.06 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.63 -0.259 . . . . 75.51 111.495 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.457 HD12 ' HG2' ' A' ' 14' ' ' GLN . 2.1 tt -87.72 112.49 49.07 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-O 120.55 0.214 . . . . 74.43 111.028 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.09 125.35 17.87 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.478 2.119 . . . . 61.13 112.182 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -24.23 62.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.444 . . . . 63.52 111.161 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -55.07 -43.64 74.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.366 -0.379 . . . . 73.53 111.474 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.431 ' HB3' ' CH2' ' A' ' 10' ' ' TRP . 1.5 m-20 -69.32 -54.8 12.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.27 -0.423 . . . . 74.51 111.202 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 41.1 mt -46.36 -33.25 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.929 -0.578 . . . . 62.25 111.422 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.549 HG12 HD22 ' A' ' 59' ' ' LEU . 8.2 mt -77.78 -38.03 24.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.315 -0.402 . . . . 70.33 111.033 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -67.11 -23.15 65.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.11 -0.495 . . . . 74.34 111.102 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -77.37 -49.8 14.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.036 0.446 . . . . 74.45 110.92 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 1.054 HD23 HD12 ' A' ' 66' ' ' LEU . 6.5 mt -61.77 -21.42 64.54 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.747 -0.661 . . . . 73.41 111.185 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.503 ' HA ' HD11 ' A' ' 38' ' ' LEU . 72.2 mt-30 -81.5 -58.72 2.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.99 0.424 . . . . 72.3 110.945 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -63.72 -37.45 87.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.844 -0.616 . . . . 75.34 111.746 -179.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.425 ' CE1' ' CB ' ' A' ' 6' ' ' PRO . 14.4 m170 -94.57 -7.9 39.75 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.764 0.283 . . . . 72.3 111.764 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.46 162.28 12.97 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.581 -0.819 . . . . 53.31 112.419 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.6 p -91.79 148.46 22.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.532 0.206 . . . . 53.3 110.524 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.732 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.7 OUTLIER -48.98 -57.08 7.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.803 0.335 . . . . 74.05 111.136 -179.729 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.8 t -48.1 -50.33 28.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.018 0.437 . . . . 61.31 110.772 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.537 ' CD1' ' HB2' ' A' ' 71' ' ' ARG . 15.9 t80 -54.09 -47.66 71.51 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.804 -0.635 . . . . 72.04 110.468 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.7 HD21 ' O ' ' A' ' 29' ' ' LEU . 13.5 mt -64.88 -41.7 95.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.944 -0.571 . . . . 71.43 110.754 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.811 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.85 -42.18 25.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.09 0.471 . . . . 73.05 110.889 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -60.53 -28.09 68.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.686 -0.688 . . . . 64.14 110.883 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 -112.56 10.02 19.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.221 -0.445 . . . . 73.13 111.131 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.91 36.2 17.72 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.801 0.334 . . . . 61.41 110.987 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.793 HD13 HD13 ' A' ' 29' ' ' LEU . 15.6 mt -95.86 -19.79 19.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 74.44 111.756 -179.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.811 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -77.13 159.66 29.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.077 0.465 . . . . 65.41 111.071 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.05 -122.22 5.56 Favored Glycine 0 N--CA 1.451 -0.355 0 CA-C-N 115.706 -0.679 . . . . 74.0 112.367 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.782 ' O ' HG23 ' A' ' 50' ' ' VAL . 14.5 m120 -116.39 119.19 34.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.784 0.326 . . . . 73.43 110.925 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.535 HG23 ' HB ' ' A' ' 26' ' ' ILE . 3.3 mp -46.07 -52.84 2.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.205 -0.452 . . . . 60.22 111.33 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -48.06 -36.96 13.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.914 -0.585 . . . . 70.11 110.742 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -85.61 -26.1 26.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.874 -0.603 . . . . 74.04 110.884 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.782 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.6 t -79.99 -25.97 11.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.289 -0.414 . . . . 72.41 111.331 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.33 -23.75 67.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.386 -0.37 . . . . 73.34 111.102 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -95.28 -28.62 14.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.246 -0.434 . . . . 71.43 110.883 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.5 m -101.99 33.7 2.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 61.42 110.92 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -162.45 126.45 3.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 64.24 110.944 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.72 168.12 14.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.474 . . . . 72.02 110.704 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.543 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -52.77 -58.11 7.93 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.896 0.379 . . . . 74.31 110.505 179.866 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.66 -28.56 65.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.144 -0.48 . . . . 74.15 110.187 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -44.48 96.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.897 -0.592 . . . . 73.3 110.264 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.592 HD23 HD21 ' A' ' 43' ' ' LEU . 8.6 mt -73.41 -32.0 64.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.564 -0.744 . . . . 72.1 110.977 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.709 HG22 ' HB3' ' A' ' 15' ' ' LEU . 33.9 t -78.4 -42.86 26.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.323 -0.399 . . . . 61.21 111.022 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.7 m -60.56 -33.99 73.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.023 -0.535 . . . . 50.24 110.521 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.462 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -82.04 -22.7 36.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.046 -0.524 . . . . 74.14 110.954 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.821 ' HA ' HD21 ' A' ' 29' ' ' LEU . 38.9 t80 -83.83 -22.81 31.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.142 -0.481 . . . . 74.54 110.989 179.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -84.15 -54.28 4.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 73.43 111.219 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.462 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 2.0 p-80 -62.94 -26.22 68.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.987 -0.551 . . . . 74.11 111.18 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 1.054 HD12 HD23 ' A' ' 29' ' ' LEU . 3.0 tt -48.94 -42.83 38.65 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.951 0.405 . . . . 43.31 110.91 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -79.02 -39.03 35.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.859 -0.609 . . . . 75.4 110.499 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.02 -45.13 96.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.951 -0.568 . . . . 75.51 110.685 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.5 p -89.89 -4.58 57.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.903 -0.589 . . . . 74.42 111.373 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.47 36.46 16.85 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.797 0.332 . . . . 72.24 111.24 179.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.537 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 7.3 mmt180 -88.58 46.05 1.35 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.246 -0.434 . . . . 72.22 111.517 -179.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.468 ' CE1' HD22 ' A' ' 66' ' ' LEU . 93.3 m-85 -68.17 173.22 4.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.8 0.333 . . . . 75.43 110.791 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -71.67 142.55 49.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.28 -0.418 . . . . 64.33 110.899 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 174.02 38.7 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.693 -0.765 . . . . 62.24 112.57 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.3 m -132.26 -45.24 0.92 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.883 0.373 . . . . 63.42 111.027 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -64.15 -33.21 75.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.987 -0.551 . . . . 70.54 110.957 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.458 ' O ' HG23 ' A' ' 78' ' ' ILE . 0.3 OUTLIER -112.26 120.77 42.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 55.05 110.966 179.978 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.458 HG23 ' O ' ' A' ' 77' ' ' SER . 28.2 pt -157.25 160.2 2.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 62.3 111.125 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 9.1 m -132.09 155.55 47.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 73.14 110.886 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -70.05 111.9 6.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.873 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.5 t -151.03 136.53 11.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 73.11 111.129 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.83 127.25 43.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 74.2 110.895 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -135.7 173.93 11.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 72.11 110.876 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 60.42 170.06 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 72.11 110.88 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.4 t 63.49 111.65 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 64.52 111.122 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -169.33 148.04 3.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 75.13 110.915 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -86.85 154.37 20.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 75.24 110.891 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 12.2 m -110.4 -30.96 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 74.22 111.131 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.4 mttp -77.47 63.16 2.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 74.42 110.924 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.7 mp 60.54 110.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.142 -0.481 . . . . 52.35 110.932 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -176.75 128.22 0.18 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 70.42 110.913 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 68.4 -69.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 72.35 110.991 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 61.79 155.5 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.005 -0.543 . . . . 64.42 110.877 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.6 pttt 43.67 66.0 5.14 Favored Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 116.105 -0.498 . . . . 44.24 111.446 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.27 141.18 31.78 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.556 2.171 . . . . 54.32 112.304 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -159.71 123.84 3.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 75.22 110.901 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -103.46 141.43 35.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 74.21 110.895 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.1 m -88.32 119.97 29.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.266 -0.425 . . . . 65.4 110.893 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.5 120.25 0.92 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 74.53 110.936 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.3 m 60.55 109.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 72.15 110.912 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -108.22 101.3 10.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 62.22 110.856 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -109.89 122.33 47.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 75.4 110.871 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 25.5 p -91.82 -33.33 15.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.209 -0.451 . . . . 55.53 110.873 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.773 HD22 ' HG3' ' A' ' 108' ' ' PRO . 31.2 mt 60.02 109.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 74.23 110.917 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -69.64 169.19 13.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 72.43 110.874 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 63.71 -80.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.154 -0.476 . . . . 65.02 110.977 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 147.41 66.84 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.757 -0.735 . . . . 64.32 112.52 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.773 ' HG3' HD22 ' A' ' 104' ' ' LEU . 56.6 Cg_endo -70.85 173.04 12.54 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.553 2.168 . . . . 71.45 112.278 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -57.41 -160.92 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.613 2.209 . . . . 54.22 112.225 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.438 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 4.1 mttt -108.24 29.78 7.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 74.3 110.945 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.453 ' CE2' ' HB2' ' A' ' 178' ' ' ALA . 39.4 p90 -153.79 160.68 42.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.279 -0.419 . . . . 73.01 110.91 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 190' ' ' LEU . 79.9 m -128.93 103.5 7.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.132 -0.485 . . . . 74.14 110.897 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.404 ' HG2' ' N ' ' A' ' 114' ' ' SER . 5.3 tttt -103.14 144.27 31.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.317 -0.401 . . . . 70.32 111.045 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.498 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -139.44 120.36 14.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.161 -0.472 . . . . 73.25 110.905 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 30.6 t -75.36 106.36 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 74.25 111.288 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.498 HD22 ' O ' ' A' ' 114' ' ' SER . 3.9 mm? -80.75 -44.77 18.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 73.4 110.844 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -123.34 107.84 12.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.441 . . . . 75.11 111.049 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.5 mttm -62.44 139.58 58.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 71.22 110.803 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -106.66 -106.27 3.1 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.759 -0.734 . . . . 53.23 112.452 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -90.48 -43.8 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.965 0.412 . . . . 73.04 110.745 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.458 ' O ' HG23 ' A' ' 122' ' ' THR . 0.3 OUTLIER 72.26 38.92 0.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.918 -0.583 . . . . 73.4 110.763 -179.796 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.458 HG23 ' O ' ' A' ' 121' ' ' LYS . 0.8 OUTLIER -160.59 -44.76 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.007 -0.542 . . . . 64.22 110.785 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -85.17 106.32 16.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 75.23 110.873 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.4 ' CD1' ' O ' ' A' ' 122' ' ' THR . 18.2 m-85 -119.22 147.78 43.7 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.186 -0.461 . . . . 72.24 110.885 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.567 ' CB ' HG11 ' A' ' 166' ' ' VAL . 52.0 Cg_exo -54.33 127.99 28.19 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.579 2.186 . . . . 43.53 112.303 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.0 mmtm -103.21 147.35 27.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 75.51 110.882 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 11.5 mtpt -55.64 111.25 0.86 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 73.21 111.02 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 107.42 -16.37 37.98 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.759 -0.734 . . . . 74.11 112.693 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.76 136.78 32.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.803 0.335 . . . . 74.12 110.875 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.705 HG12 ' HG3' ' A' ' 165' ' ' LYS . 23.9 m -70.82 171.88 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.253 -0.43 . . . . 73.33 111.302 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.874 HG22 ' O ' ' A' ' 164' ' ' PHE . 19.9 m -156.63 145.47 11.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.773 -0.649 . . . . 75.34 110.529 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.451 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -127.2 117.83 23.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.683 0.278 . . . . 72.2 110.755 179.865 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.552 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.4 p -155.16 169.58 23.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.976 0.417 . . . . 74.33 111.216 -179.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.621 ' HB3' HD13 ' A' ' 149' ' ' ILE . 12.3 m95 -106.36 165.62 11.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.858 -0.61 . . . . 71.13 110.074 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.483 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 39.9 p90 -161.76 136.21 6.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.041 0.448 . . . . 71.54 111.837 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.849 HG21 HG11 ' A' ' 5' ' ' VAL . 1.9 m -122.77 108.8 13.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.728 -0.669 . . . . 73.32 110.19 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.672 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -97.15 146.02 18.11 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.573 -0.823 . . . . 75.23 113.55 -179.128 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.583 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -152.28 152.53 32.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.767 0.318 . . . . 70.32 110.575 179.771 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.885 HD21 HD12 ' A' ' 208' ' ' ILE . 14.5 mt -87.52 -177.51 5.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 74.44 110.972 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -56.87 -43.44 81.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.103 -0.498 . . . . 65.42 110.939 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.1 -9.77 59.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.997 -0.547 . . . . 71.22 111.249 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 100.91 25.83 8.26 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.669 -0.777 . . . . 62.41 112.52 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.14 108.73 17.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.775 0.321 . . . . 42.4 110.864 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.483 HG22 HG23 ' A' ' 138' ' ' THR . 39.0 t -63.67 126.4 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 74.43 111.111 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.682 ' HB2' ' HB1' ' A' ' 206' ' ' ALA . 51.7 p90 -111.83 -28.63 7.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 75.32 111.106 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -158.47 115.16 2.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.892 0.377 . . . . 74.33 111.084 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.674 HG23 HG23 ' A' ' 136' ' ' THR . 85.5 m -132.9 106.75 7.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 51.22 110.83 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.483 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 36.0 t30 -86.33 6.7 28.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.446 . . . . 72.24 111.552 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.621 HD13 ' HB3' ' A' ' 134' ' ' TRP . 12.4 mm -79.46 160.46 4.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.682 0.277 . . . . 72.41 110.661 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.502 ' N ' HG22 ' A' ' 149' ' ' ILE . 35.6 mm-40 -146.29 -85.89 0.11 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.462 -0.335 . . . . 54.34 111.055 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 21.4 p -146.69 166.08 27.66 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.843 0.354 . . . . 73.31 110.988 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . 0.681 ' CB ' HG21 ' A' ' 12' ' ' VAL . 2.9 p -73.17 139.28 46.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 72.22 110.802 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -58.52 -28.61 65.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 72.0 111.231 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.31 -30.88 54.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 73.02 111.018 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 7.3 tttp -86.39 -33.46 20.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.27 -0.423 . . . . 74.04 110.999 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.93 175.38 13.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 75.34 110.858 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.12 30.53 4.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 72.55 110.892 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 23.5 m-20 -113.12 57.43 0.67 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 71.42 110.815 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.428 ' HB1' ' CH2' ' A' ' 134' ' ' TRP . . . -157.18 127.94 6.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.139 -0.482 . . . . 61.12 110.994 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -132.09 121.62 17.86 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 74.24 110.855 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.416 ' HG3' ' CZ2' ' A' ' 134' ' ' TRP . 51.9 Cg_exo -54.67 150.7 34.72 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.396 2.064 . . . . 63.43 112.259 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 3.3 tt -77.89 121.13 23.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.217 -0.447 . . . . 75.25 110.49 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.652 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.3 OUTLIER -99.25 121.73 41.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.945 0.402 . . . . 75.13 111.402 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.874 ' O ' HG22 ' A' ' 131' ' ' VAL . 14.7 p90 -149.25 141.02 23.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.989 -0.55 . . . . 74.32 110.652 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.705 ' HG3' HG12 ' A' ' 130' ' ' VAL . 36.2 mttp -78.07 138.04 38.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.988 0.423 . . . . 64.41 111.151 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.567 HG11 ' CB ' ' A' ' 125' ' ' PRO . 35.8 m -87.76 149.12 4.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.84 -0.618 . . . . 63.35 111.157 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 68.25 24.61 74.81 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.783 -0.723 . . . . 60.21 112.635 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.734 HG23 ' HG2' ' A' ' 170' ' ' LYS . 5.6 m -132.94 43.26 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.867 0.365 . . . . 73.32 111.037 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 45.2 36.38 5.41 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 121.151 -0.547 . . . . 73.41 113.168 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . 0.734 ' HG2' HG23 ' A' ' 168' ' ' VAL . 2.7 mmtm -82.47 -47.06 12.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.899 0.38 . . . . 75.3 110.997 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -119.07 -179.33 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.06 -0.518 . . . . 72.53 110.962 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.572 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.5 pt -58.41 160.69 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.375 -0.375 . . . . 74.03 111.265 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -68.95 -27.91 66.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.198 -0.455 . . . . 73.05 111.259 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . 0.411 ' HA2' ' CE3' ' A' ' 196' ' ' TRP . . . -75.21 -37.46 42.37 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.595 -0.812 . . . . 53.14 111.98 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.691 ' CD1' HD11 ' A' ' 190' ' ' LEU . 1.8 t90 -77.86 -33.15 52.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.985 0.421 . . . . 60.44 111.033 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -63.22 -38.58 91.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.962 -0.563 . . . . 61.01 110.636 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . 0.429 ' O ' HG23 ' A' ' 181' ' ' THR . 2.8 mm-40 -75.5 -29.37 59.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.988 -0.551 . . . . 42.21 110.824 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.662 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -79.13 -61.94 1.85 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.436 . . . . 63.31 111.32 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.789 HD21 HG21 ' A' ' 218' ' ' VAL . 6.9 mt -53.77 -33.77 56.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.028 -0.533 . . . . 75.14 111.031 -179.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 49.3 tp -58.84 -28.17 65.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.368 -0.378 . . . . 74.31 110.825 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . 0.429 HG23 ' O ' ' A' ' 177' ' ' GLU . 26.4 p -91.75 -2.96 56.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 71.3 111.404 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 1.1 ttp -77.7 156.63 30.55 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.79 0.329 . . . . 74.13 110.797 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -112.79 167.96 10.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 65.44 111.134 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . 0.442 ' HA ' HD22 ' A' ' 220' ' ' LEU . 3.9 tttp -68.16 126.48 29.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.961 -0.563 . . . . 72.41 111.034 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 69.67 33.14 71.16 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.759 -0.734 . . . . 63.02 112.683 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -118.34 148.76 42.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.793 0.33 . . . . 64.02 110.849 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -117.09 139.75 50.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.297 -0.411 . . . . 74.01 110.213 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -145.65 173.86 11.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.151 0.5 . . . . 74.42 111.866 -179.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.75 114.93 10.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.585 -0.734 . . . . 63.25 109.71 179.183 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.691 HD11 ' CD1' ' A' ' 175' ' ' TRP . 0.9 OUTLIER -126.11 141.87 51.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.501 . . . . 55.53 112.131 -178.948 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.565 ' HG3' HG23 ' A' ' 215' ' ' THR . 0.2 OUTLIER -116.76 112.89 21.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.556 -0.747 . . . . 71.1 110.236 179.345 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.466 HD11 ' CZ ' ' A' ' 216' ' ' PHE . 3.7 mp -101.09 143.48 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.971 0.415 . . . . 75.42 111.637 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.42 ' CB ' ' HD2' ' A' ' 194' ' ' PRO . 4.1 mt-10 -79.99 167.71 31.54 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 73.41 110.59 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . 0.42 ' HD2' ' CB ' ' A' ' 193' ' ' GLU . 18.8 Cg_endo -60.36 -44.03 30.55 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.45 2.1 . . . . 62.25 112.257 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.03 -25.27 11.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 73.23 111.296 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.438 ' CD2' ' HB2' ' A' ' 110' ' ' LYS . 7.4 m0 -118.02 36.95 4.13 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.472 -0.331 . . . . 53.22 111.097 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -155.25 -83.59 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 61.04 111.357 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . 0.491 ' HD2' HG21 ' A' ' 208' ' ' ILE . 35.6 m-85 -105.59 -27.91 11.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.898 0.38 . . . . 75.15 110.84 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 105.38 176.8 24.22 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.832 -0.699 . . . . 74.2 112.789 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -60.23 -34.65 73.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.79 0.328 . . . . 75.53 110.858 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -49.49 77.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 73.24 110.707 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 111.34 -158.65 14.21 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.839 -0.696 . . . . 52.44 112.605 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.451 ' HG3' ' CD1' ' A' ' 198' ' ' TYR . 0.0 OUTLIER -149.77 83.64 6.23 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 120.82 0.343 . . . . 63.14 110.518 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.39 -43.6 43.35 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.725 2.284 . . . . 73.51 112.727 -179.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.64 -42.13 70.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.889 0.376 . . . . 71.44 111.036 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.682 ' HB1' ' HB2' ' A' ' 145' ' ' PHE . . . -96.95 26.73 4.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.043 -0.526 . . . . 63.42 111.299 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.19 31.13 4.8 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.405 -0.361 . . . . 72.24 111.091 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.885 HD12 HD21 ' A' ' 139' ' ' LEU . 18.5 mm -95.72 111.72 56.71 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 74.22 111.19 -179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.29 161.3 43.19 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.407 2.071 . . . . 62.22 112.214 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_exo -51.62 118.62 4.6 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.489 2.126 . . . . 64.31 112.292 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 65.07 72.5 0.43 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.226 -0.443 . . . . 62.1 110.849 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -122.33 151.64 40.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.45 . . . . 72.34 111.256 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . 0.523 ' O ' HD23 ' A' ' 214' ' ' LEU . 5.6 tptt -88.7 148.12 24.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.074 -0.512 . . . . 74.2 110.45 179.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.523 HD23 ' O ' ' A' ' 213' ' ' LYS . 8.2 mt -129.86 109.41 10.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.839 0.352 . . . . 73.34 111.363 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.565 HG23 ' HG3' ' A' ' 191' ' ' GLU . 58.5 m -106.97 138.92 42.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.062 -0.517 . . . . 71.31 110.786 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.672 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 9.0 p90 -161.8 -175.4 4.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.265 -0.425 . . . . 64.1 111.053 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . 0.457 ' HG2' ' HA ' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -144.65 147.96 33.7 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 73.32 110.807 -179.946 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.789 HG21 HD21 ' A' ' 179' ' ' LEU . 1.5 t -125.89 153.36 33.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.98 -0.555 . . . . 71.13 112.025 -178.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -133.93 106.11 7.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.846 -0.615 . . . . 74.54 110.031 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.621 HD21 ' CG1' ' A' ' 223' ' ' ILE . 1.3 tt -69.93 130.97 43.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.406 -0.361 . . . . 55.31 110.996 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . . . . . . . . . 28.1 t -109.3 -29.72 2.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.17 -0.468 . . . . 74.55 111.466 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . 0.408 ' N ' HD23 ' A' ' 220' ' ' LEU . 4.0 t0 -171.11 161.67 6.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.869 0.366 . . . . 74.2 111.267 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.678 HG23 HG12 ' A' ' 131' ' ' VAL . 39.3 mt -141.96 111.45 2.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.087 -0.506 . . . . 74.04 110.99 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 74.4 110.899 179.979 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.843 0.354 . . . . 64.35 111.183 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.767 ' HB2' ' O ' ' A' ' 73' ' ' LYS . . . 61.14 154.99 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 62.24 111.081 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.36 24.72 1.92 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 54.2 111.254 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -173.99 168.44 4.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.842 0.353 . . . . 71.31 111.24 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 1.033 HG11 HG21 ' A' ' 136' ' ' THR . 60.1 t -124.02 116.09 27.49 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.102 -0.499 . . . . 73.14 111.063 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.446 ' CB ' ' CE1' ' A' ' 32' ' ' HIS . 72.0 Cg_endo -77.18 137.75 17.38 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.708 2.272 . . . . 75.21 112.456 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -82.35 148.1 28.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 72.44 110.76 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.89 97.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 71.34 111.207 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.95 -16.36 63.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.482 . . . . 51.41 111.397 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.451 ' CZ3' ' HA ' ' A' ' 25' ' ' ILE . 4.1 m-90 -129.44 161.87 29.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.948 0.404 . . . . 70.41 110.812 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.5 m -100.48 150.02 23.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.873 -0.603 . . . . 71.3 110.148 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.485 ' O ' ' HG2' ' A' ' 16' ' ' ARG . 46.3 t -56.85 -36.84 51.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.958 0.409 . . . . 62.24 110.47 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.411 ' O ' ' HB2' ' A' ' 17' ' ' SER . 3.7 pt-20 -69.1 -22.71 63.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.814 -0.63 . . . . 55.25 110.852 179.366 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.434 ' O ' ' HB2' ' A' ' 17' ' ' SER . 26.0 mt-30 -82.03 -54.49 5.26 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.358 -0.383 . . . . 75.53 111.174 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.8 ' HB3' HG22 ' A' ' 60' ' ' VAL . 7.1 mt -50.11 -66.38 0.4 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 60.3 111.782 -179.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.485 ' HG2' ' O ' ' A' ' 12' ' ' VAL . 2.5 ptm180 -59.4 -25.23 64.12 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 120.957 -0.297 . . . . 74.44 111.242 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.434 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -52.03 179.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.919 0.39 . . . . 55.33 111.144 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -110.36 16.43 21.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.055 -0.521 . . . . 73.32 111.199 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.85 -23.75 8.48 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.497 -0.32 . . . . 74.42 111.184 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.918 HD12 HD11 ' A' ' 25' ' ' ILE . 1.2 tm? -80.67 117.2 66.78 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.454 -0.339 . . . . 74.12 110.856 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.546 ' HD2' HD22 ' A' ' 20' ' ' LEU . 37.3 Cg_endo -65.85 123.65 11.62 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.466 2.11 . . . . 72.22 112.425 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -27.82 69.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.112 -0.495 . . . . 62.23 111.278 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.462 ' HA ' HD12 ' A' ' 26' ' ' ILE . 3.0 ttpt -53.47 -39.51 64.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.909 0.385 . . . . 75.42 111.122 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.53 -53.65 9.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.059 -0.519 . . . . 41.25 110.658 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.918 HD11 HD12 ' A' ' 20' ' ' LEU . 36.2 mt -45.63 -33.63 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.799 -0.637 . . . . 71.01 111.342 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.747 ' HB ' HG23 ' A' ' 47' ' ' ILE . 6.0 mt -76.02 -40.21 37.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 61.02 111.037 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -69.43 -23.53 63.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.03 -0.532 . . . . 73.15 111.263 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.451 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 22.9 t80 -74.84 -46.4 36.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.964 0.411 . . . . 75.52 111.124 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.792 HD21 ' HA ' ' A' ' 63' ' ' TYR . 4.5 mt -69.03 -24.67 64.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.963 -0.562 . . . . 74.51 111.185 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.594 ' HA ' HD11 ' A' ' 38' ' ' LEU . 74.6 mt-30 -80.2 -28.37 38.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.387 -0.37 . . . . 73.14 110.98 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -94.29 -41.06 9.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.297 -0.41 . . . . 64.31 111.113 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.451 ' ND1' ' CZ ' ' A' ' 28' ' ' PHE . 11.7 m170 -90.3 -7.32 53.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.301 -0.408 . . . . 75.35 111.477 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.8 164.83 12.99 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.698 -0.763 . . . . 53.22 112.401 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.3 p -92.43 148.39 22.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.671 0.272 . . . . 74.25 110.614 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.604 ' O ' HD23 ' A' ' 44' ' ' LEU . 0.5 OUTLIER -48.66 -57.08 6.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.785 0.326 . . . . 72.24 111.012 -179.804 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.65 -50.72 31.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 74.24 110.706 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.511 ' CZ ' ' CE1' ' A' ' 65' ' ' HIS . 19.8 t80 -53.78 -47.97 70.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.751 -0.659 . . . . 72.2 110.287 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.712 HD21 ' O ' ' A' ' 29' ' ' LEU . 14.9 mt -63.83 -41.57 97.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.901 -0.591 . . . . 73.22 110.763 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.775 ' HB2' HD21 ' A' ' 44' ' ' LEU . . . -47.55 -40.21 18.35 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.2 -0.455 . . . . 71.45 111.095 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.41 ' HB3' ' CD2' ' A' ' 41' ' ' HIS . 1.7 mt-10 -48.59 -48.78 38.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.864 -0.607 . . . . 64.43 110.972 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.41 ' CD2' ' HB3' ' A' ' 40' ' ' GLU . 5.9 m-70 -103.45 13.64 33.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 75.12 111.223 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 58.17 43.38 20.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.837 0.351 . . . . 64.15 110.894 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.735 HD13 HD13 ' A' ' 29' ' ' LEU . 20.4 mt -95.22 -20.91 18.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 70.02 111.615 -179.593 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.775 HD21 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -75.97 158.32 32.1 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.007 0.432 . . . . 44.41 111.127 -179.924 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 116.76 -124.23 6.1 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.978 -0.629 . . . . 73.44 112.42 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.894 ' O ' HG23 ' A' ' 50' ' ' VAL . 3.7 m120 -116.3 121.18 41.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.783 0.325 . . . . 74.01 110.945 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.747 HG23 ' HB ' ' A' ' 26' ' ' ILE . 2.4 mp -46.76 -50.53 5.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.223 -0.444 . . . . 55.54 111.335 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mttm -50.41 -38.64 43.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.923 -0.581 . . . . 73.54 110.753 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -85.57 -26.3 26.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.881 -0.599 . . . . 64.41 110.9 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.894 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.0 t -79.2 -26.22 12.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.28 -0.418 . . . . 74.22 111.313 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.01 -23.34 67.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.399 -0.364 . . . . 74.23 111.123 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -95.22 -28.06 15.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.444 . . . . 61.45 110.9 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.02 33.64 2.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 72.4 110.918 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -159.54 124.51 4.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 13.42 110.962 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -83.85 171.09 13.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 71.12 110.755 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.777 ' O ' HG23 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -55.27 -57.92 9.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.391 . . . . 75.21 110.599 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.32 -26.19 67.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.985 -0.552 . . . . 63.35 110.435 179.338 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -45.18 93.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.995 -0.548 . . . . 65.3 110.492 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.641 HD21 HG12 ' A' ' 26' ' ' ILE . 24.6 mt -74.68 -29.14 61.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.695 -0.684 . . . . 73.15 111.101 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.8 HG22 ' HB3' ' A' ' 15' ' ' LEU . 5.9 t -79.71 -43.52 23.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.972 0.415 . . . . 64.24 110.885 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.7 m -61.0 -34.99 75.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.911 -0.586 . . . . 70.54 110.761 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.451 ' HA ' ' CE1' ' A' ' 65' ' ' HIS . . . -81.33 -23.39 37.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 51.1 111.073 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.792 ' HA ' HD21 ' A' ' 29' ' ' LEU . 27.0 t80 -83.74 -22.79 31.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 73.41 110.945 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.1 m-20 -83.42 -54.61 4.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 73.24 111.39 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.511 ' CE1' ' CZ ' ' A' ' 37' ' ' PHE . 3.3 p-80 -62.59 -25.79 68.26 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.114 -0.494 . . . . 62.43 111.327 -179.411 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.715 ' O ' HD23 ' A' ' 66' ' ' LEU . 5.0 tt -53.25 -40.07 64.32 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.877 0.37 . . . . 71.41 110.935 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -78.71 -38.93 37.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.029 -0.532 . . . . 73.11 110.621 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.86 -41.26 91.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.023 -0.535 . . . . 73.4 110.772 179.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.9 p -90.85 -4.14 56.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.938 -0.574 . . . . 64.51 111.437 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.98 37.93 11.38 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.735 0.302 . . . . 73.32 111.351 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.425 ' HB2' ' CD1' ' A' ' 37' ' ' PHE . 27.0 mtt-85 -94.13 44.1 1.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.383 -0.371 . . . . 63.34 111.092 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.534 ' HA ' HD21 ' A' ' 66' ' ' LEU . 86.0 m-85 -64.32 177.75 0.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 71.23 110.832 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.767 ' O ' ' HB2' ' A' ' 2' ' ' ALA . 8.3 tttt -68.1 153.03 44.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 63.43 110.913 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -112.98 91.83 0.6 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.753 -0.737 . . . . 51.1 112.565 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.1 t 42.99 92.75 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.853 0.359 . . . . 64.32 111.559 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -134.72 -45.78 0.74 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 65.21 110.991 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.1 m -135.28 138.31 43.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.986 -0.552 . . . . 64.43 110.915 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 3.8 mp -113.24 -35.62 2.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 73.22 111.135 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.0 m -177.78 178.45 0.99 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 63.24 110.902 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -170.38 140.87 1.9 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.453 . . . . 74.51 110.895 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.474 HG12 ' N ' ' A' ' 82' ' ' SER . 21.5 t -132.45 158.81 43.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 62.31 111.096 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.474 ' N ' HG12 ' A' ' 81' ' ' VAL . 3.8 m -136.52 143.41 43.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 54.33 110.89 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -99.83 -41.18 7.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 74.52 110.892 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -87.31 136.32 32.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.99 -0.55 . . . . 55.42 110.918 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 28.4 t -122.78 124.66 71.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 74.31 111.078 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -140.89 -50.88 0.45 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 74.23 110.879 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -80.6 -32.03 36.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 51.23 110.926 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.5 t -86.55 89.82 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 73.11 111.153 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -141.9 90.37 2.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 75.23 110.872 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.5 tp -177.58 -39.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 72.03 110.958 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -79.85 -176.3 5.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.092 -0.504 . . . . 72.51 110.887 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -116.78 82.03 1.73 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 53.22 110.897 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -67.96 135.18 51.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 65.22 110.843 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 11.4 pttm -108.59 147.22 35.29 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 64.35 110.926 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.6 98.57 0.97 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.547 2.165 . . . . 74.11 112.331 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.7 tptt -159.85 145.35 15.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 55.44 110.869 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -136.11 79.16 1.75 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.147 -0.478 . . . . 72.24 110.891 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.7 p -152.86 163.27 40.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 73.32 110.914 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -104.81 -31.52 9.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 64.31 110.915 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -161.07 132.32 5.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 65.4 110.872 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -150.2 96.31 2.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 71.11 110.895 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -149.72 120.79 7.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 74.0 110.931 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.5 m 60.33 92.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 71.31 110.862 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -148.17 108.5 4.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 71.24 110.91 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -159.47 -45.08 0.05 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 74.25 110.897 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -159.46 78.27 0.71 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.075 -0.511 . . . . 73.22 110.888 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.25 88.45 1.91 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.714 -0.755 . . . . 44.42 112.498 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.94 170.81 15.92 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.532 2.155 . . . . 73.44 112.304 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.62 -178.87 2.49 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.583 2.188 . . . . 64.11 112.252 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.439 ' HB2' ' CD2' ' A' ' 196' ' ' TRP . 1.8 mptt -113.68 29.24 8.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 74.14 110.957 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.427 ' CE1' ' HB2' ' A' ' 177' ' ' GLU . 34.3 p90 -151.99 152.36 32.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.207 -0.451 . . . . 73.23 110.886 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 62.9 m -124.08 103.62 8.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 62.03 110.947 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt -97.09 151.34 19.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.222 -0.445 . . . . 75.24 110.834 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.421 ' O ' HD22 ' A' ' 116' ' ' LEU . 1.4 t -148.69 118.62 7.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.248 -0.433 . . . . 72.34 111.018 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 40.7 t -78.62 106.33 9.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.461 . . . . 61.41 111.242 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.527 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.2 mm? -81.8 -41.26 21.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.419 . . . . 73.02 110.7 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 8.2 ttpp -125.51 109.15 12.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 61.45 111.008 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 17.4 mttp -61.14 139.44 58.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 74.44 110.937 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -97.33 -108.3 2.59 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.802 -0.713 . . . . 65.51 112.478 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -96.42 -37.32 10.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.967 0.413 . . . . 73.51 110.7 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.4 36.87 0.61 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.885 -0.598 . . . . 74.42 110.911 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 58.8 m -163.09 -43.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 71.34 111.086 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -81.81 86.05 6.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.286 -0.416 . . . . 74.32 111.158 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -102.74 143.36 26.45 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 75.42 110.743 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.633 ' HA ' HG21 ' A' ' 223' ' ' ILE . 52.7 Cg_exo -55.51 130.96 43.36 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.559 2.173 . . . . 74.51 112.575 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.12 147.31 24.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 72.11 110.735 179.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -53.3 116.94 2.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.329 -0.396 . . . . 75.52 111.139 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 93.8 -4.27 71.86 Favored Glycine 0 CA--C 1.519 0.326 0 C-N-CA 120.732 -0.747 . . . . 73.52 112.876 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.21 139.5 30.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.869 0.366 . . . . 70.0 110.972 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.613 HG12 ' O ' ' A' ' 224' ' ' ASP . 7.8 p -69.39 162.23 3.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 72.43 111.055 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.92 HG12 HG23 ' A' ' 223' ' ' ILE . 13.4 m -154.86 145.95 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 65.13 111.031 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.463 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.1 OUTLIER -128.08 117.97 22.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.722 0.296 . . . . 74.55 110.951 179.909 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.447 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 22.9 p -151.36 166.76 30.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.92 0.39 . . . . 51.44 111.216 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.652 ' O ' HG13 ' A' ' 218' ' ' VAL . 15.8 m95 -100.93 160.9 13.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.017 -0.538 . . . . 71.43 109.961 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.486 ' CZ ' ' HB2' ' A' ' 148' ' ' ASN . 17.4 p90 -161.28 138.1 8.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.917 0.389 . . . . 74.31 111.632 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 1.033 HG21 HG11 ' A' ' 5' ' ' VAL . 3.5 m -126.33 109.06 11.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.999 -0.546 . . . . 74.43 111.043 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.724 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -86.94 138.31 15.41 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.834 -0.698 . . . . 73.1 113.111 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.863 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.98 132.56 14.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.705 0.288 . . . . 50.44 110.522 179.547 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.494 HD21 HG23 ' A' ' 208' ' ' ILE . 40.8 mt -70.44 -178.37 1.73 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.381 -0.372 . . . . 74.03 110.991 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -57.15 -42.71 81.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.086 -0.507 . . . . 61.21 110.774 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -76.03 -3.08 33.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.935 -0.575 . . . . 71.12 111.493 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . 0.434 ' O ' HG22 ' A' ' 138' ' ' THR . . . 90.67 8.39 65.63 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.629 -0.796 . . . . 74.2 112.91 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.01 110.01 11.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.785 0.326 . . . . 72.14 110.684 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 137' ' ' GLY . 7.3 p -63.67 133.04 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.289 -0.414 . . . . 54.23 111.158 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.429 ' CZ ' ' HA3' ' A' ' 137' ' ' GLY . 46.1 p90 -111.22 -29.3 7.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 72.03 110.832 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -168.21 121.8 0.9 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 64.5 110.866 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.674 ' OG1' HG23 ' A' ' 136' ' ' THR . 12.5 t -142.82 128.25 18.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.37 -0.377 . . . . 74.15 111.077 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.486 ' HB2' ' CZ ' ' A' ' 135' ' ' TYR . 27.3 t30 -89.14 53.29 2.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.096 -0.502 . . . . 65.2 110.631 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . 3.2 mt -146.42 109.46 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 52.1 111.394 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -169.9 139.19 1.87 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.257 -0.429 . . . . 73.43 111.01 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . 0.503 HG22 ' HB2' ' A' ' 159' ' ' ALA . 75.8 p -146.48 90.97 1.99 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.157 -0.474 . . . . 75.41 110.878 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 77.2 p -83.92 165.47 18.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 72.22 110.922 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -73.44 -36.19 65.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 64.52 111.093 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.08 -31.43 70.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 63.42 110.898 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.18 1.72 43.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 71.1 111.401 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.8 29.58 16.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.834 0.35 . . . . 72.42 110.962 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 57.3 87.48 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.23 -0.441 . . . . 73.24 110.952 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 11.0 m-20 -146.78 104.2 3.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 73.22 110.891 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.503 ' HB2' HG22 ' A' ' 151' ' ' THR . . . -127.64 138.99 53.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 22.22 111.116 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 161' ' ' PRO . 23.4 mttm -138.52 134.69 17.54 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 70.11 110.776 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 160' ' ' LYS . 31.1 Cg_exo -58.76 152.18 58.7 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.378 2.052 . . . . 53.32 112.351 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.62 125.56 29.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 70.51 110.306 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.628 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.2 OUTLIER -99.66 122.91 43.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.991 0.424 . . . . 73.44 111.585 -179.66 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.867 ' O ' HG22 ' A' ' 131' ' ' VAL . 6.6 p90 -151.31 143.62 24.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.859 -0.609 . . . . 74.32 110.516 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.583 ' O ' HG22 ' A' ' 168' ' ' VAL . 34.6 mttt -81.7 142.0 33.08 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 75.33 111.043 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.5 m -87.69 149.03 4.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.897 -0.592 . . . . 73.2 111.285 -179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 67.91 25.11 74.36 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.851 -0.69 . . . . 70.52 112.592 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.608 HG23 ' HG2' ' A' ' 170' ' ' LYS . 27.3 m -131.3 41.11 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.788 0.327 . . . . 73.24 111.174 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 43.22 35.25 2.49 Favored Glycine 0 C--N 1.331 0.3 0 C-N-CA 121.194 -0.527 . . . . 72.12 113.151 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . 0.608 ' HG2' HG23 ' A' ' 168' ' ' VAL . 0.0 OUTLIER -83.69 -43.55 15.43 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.794 0.331 . . . . 64.33 111.178 -179.777 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . 0.434 HG22 ' CE2' ' A' ' 164' ' ' PHE . 2.8 m -119.14 179.38 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.166 -0.47 . . . . 61.44 111.147 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.56 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 3.3 pt -59.4 163.61 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 73.41 111.217 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . 0.442 ' HD3' ' CZ2' ' A' ' 196' ' ' TRP . 14.7 ttm105 -70.13 -29.75 66.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.234 -0.439 . . . . 74.3 111.227 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -74.36 -36.49 49.86 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.603 -0.808 . . . . 74.11 112.02 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.79 ' HE1' HG21 ' A' ' 218' ' ' VAL . 1.7 t90 -79.76 -34.34 39.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.052 0.453 . . . . 73.52 110.874 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . 0.792 ' O ' HD13 ' A' ' 180' ' ' LEU . 14.8 t70 -62.82 -33.28 74.9 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.751 -0.659 . . . . 51.0 110.403 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . 0.427 ' HB2' ' CE1' ' A' ' 111' ' ' TYR . 3.9 mm-40 -80.77 -29.09 36.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.527 . . . . 71.13 110.68 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.504 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -78.8 -61.93 1.86 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.445 . . . . 73.23 111.175 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.712 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 10.1 mt -53.65 -28.14 31.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.967 -0.56 . . . . 55.25 110.794 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.792 HD13 ' O ' ' A' ' 176' ' ' ASP . 1.1 tp -53.38 -29.75 36.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.115 -0.493 . . . . 53.54 111.272 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 60.2 p -108.87 7.7 26.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.382 -0.372 . . . . 64.22 111.7 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.422 ' O ' HD13 ' A' ' 220' ' ' LEU . 26.7 mmm -69.78 106.03 2.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.889 0.376 . . . . 70.33 110.884 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.09 150.25 48.46 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.969 -0.56 . . . . 74.14 111.036 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . 0.71 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.0 OUTLIER -56.12 119.94 6.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.967 -0.56 . . . . 62.02 110.9 -179.869 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 74.97 20.33 79.5 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.705 -0.76 . . . . 32.23 112.431 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -96.95 143.41 27.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.846 0.355 . . . . 63.23 111.081 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt -110.45 132.9 53.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.061 -0.518 . . . . 74.33 109.787 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -143.08 171.52 13.96 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.235 0.54 . . . . 74.34 112.09 -179.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . 0.449 ' HA ' ' HA ' ' A' ' 217' ' ' GLU . 0.0 OUTLIER -137.09 117.6 13.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.299 -0.864 . . . . 74.22 109.504 179.587 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.923 HD21 ' CE2' ' A' ' 216' ' ' PHE . 2.2 pt? -127.6 141.23 51.68 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.212 -0.595 . . . . 34.41 112.545 -178.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.724 ' HG3' HG23 ' A' ' 215' ' ' THR . 1.4 mp0 -113.59 116.12 29.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.271 -0.877 . . . . 74.24 109.864 179.034 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.425 HG12 ' CE1' ' A' ' 216' ' ' PHE . 4.5 mm -91.42 144.81 8.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.857 0.36 . . . . 60.41 111.372 -179.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -84.47 154.49 62.53 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.069 -0.514 . . . . 74.41 110.481 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . 0.415 ' O ' ' N ' ' A' ' 199' ' ' GLY . 63.7 Cg_exo -51.07 -44.2 43.76 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.458 2.105 . . . . 64.42 112.376 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -62.36 -19.74 63.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 74.02 111.629 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.442 ' CZ2' ' HD3' ' A' ' 173' ' ' ARG . 6.3 m0 -118.55 37.1 4.16 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.64 0.257 . . . . 71.5 111.528 -179.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -156.19 -84.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.634 -0.257 . . . . 74.34 111.581 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . 0.881 ' CE2' HD13 ' A' ' 208' ' ' ILE . 19.6 m-85 -104.96 -26.19 12.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.853 0.359 . . . . 74.41 111.061 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 194' ' ' PRO . . . 105.85 163.33 23.17 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.833 -0.699 . . . . 54.41 112.474 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 28.7 mtmt -55.49 -30.91 61.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.825 0.345 . . . . 75.53 110.824 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 18.8 mtpt -61.21 -48.53 81.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 73.14 110.795 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 106.72 166.32 22.53 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.836 -0.697 . . . . 34.04 112.487 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.841 ' HB3' HD12 ' A' ' 208' ' ' ILE . 0.7 OUTLIER -110.68 90.02 10.0 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.701 0.286 . . . . 62.44 110.832 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.17 -21.59 55.21 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.459 2.106 . . . . 73.54 112.409 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.46 -41.6 85.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.318 -0.401 . . . . 64.42 110.923 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -108.11 27.33 9.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.061 -0.518 . . . . 62.32 111.199 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 56.16 54.44 7.82 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.429 . . . . 73.44 111.108 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.881 HD13 ' CE2' ' A' ' 198' ' ' TYR . 27.1 mt -117.35 111.63 39.98 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 74.4 111.06 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . 0.41 ' HA ' ' HD3' ' A' ' 210' ' ' PRO . 38.4 Cg_exo -60.68 157.76 35.84 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.525 2.15 . . . . 55.41 112.373 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 209' ' ' PRO . 31.2 Cg_exo -61.17 130.52 32.67 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.651 2.234 . . . . 75.34 112.142 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 64.09 69.6 0.53 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.337 -0.392 . . . . 54.14 110.873 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -122.87 149.23 44.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.216 -0.447 . . . . 64.3 111.261 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . 0.9 ' O ' HD23 ' A' ' 214' ' ' LEU . 2.3 tttt -83.94 149.77 26.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.03 -0.532 . . . . 74.1 110.554 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.9 HD23 ' O ' ' A' ' 213' ' ' LYS . 7.2 mt -136.19 109.35 7.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.89 0.376 . . . . 54.11 111.576 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.724 HG23 ' HG3' ' A' ' 191' ' ' GLU . 45.7 m -109.95 138.23 46.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 71.14 110.184 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.923 ' CE2' HD21 ' A' ' 190' ' ' LEU . 12.4 p90 -157.79 120.36 3.83 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 112.386 0.513 . . . . 75.52 112.386 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . 0.449 ' HA ' ' HA ' ' A' ' 189' ' ' ARG . 2.6 mt-10 -74.17 136.46 42.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.628 -0.714 . . . . 64.14 110.654 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.79 HG21 ' HE1' ' A' ' 175' ' ' TRP . 3.3 t -122.41 150.89 26.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.077 -0.511 . . . . 75.35 111.525 -178.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -136.77 110.18 7.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.039 -0.528 . . . . 54.43 110.491 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.828 HD21 HG13 ' A' ' 223' ' ' ILE . 3.5 tt -70.53 132.16 45.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.404 -0.362 . . . . 74.3 111.145 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.408 HG21 ' HE1' ' A' ' 134' ' ' TRP . 30.8 t -109.68 -30.69 2.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.103 -0.499 . . . . 53.44 111.429 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . 0.423 ' N ' HD23 ' A' ' 220' ' ' LEU . 6.5 t70 -168.94 159.3 9.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.875 0.369 . . . . 75.24 111.107 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.92 HG23 HG12 ' A' ' 131' ' ' VAL . 29.2 mt -142.25 112.01 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 64.2 111.157 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . 0.613 ' O ' HG12 ' A' ' 130' ' ' VAL . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 73.33 110.826 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mtt . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.847 0.356 . . . . 63.42 111.163 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.15 132.99 49.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 34.31 111.05 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.576 ' O ' ' HB2' ' A' ' 4' ' ' ALA . . . 59.96 98.69 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.225 -0.443 . . . . 53.43 111.008 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.576 ' HB2' ' O ' ' A' ' 3' ' ' ALA . . . 167.07 89.57 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.209 -0.45 . . . . 72.45 111.105 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.954 HG11 HG21 ' A' ' 136' ' ' THR . 40.7 t -90.38 110.05 38.08 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.437 -0.347 . . . . 65.2 110.84 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.457 ' HB3' ' CE1' ' A' ' 32' ' ' HIS . 93.0 Cg_endo -79.21 135.06 11.88 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.533 2.155 . . . . 74.2 112.46 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 -80.31 150.63 29.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.181 -0.463 . . . . 63.23 110.803 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.13 96.03 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.184 -0.462 . . . . 75.42 111.209 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.63 -16.46 64.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.119 -0.491 . . . . 74.13 111.396 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 6.0 m-90 -136.0 173.67 11.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.848 0.356 . . . . 73.34 110.789 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.449 HG23 ' HB2' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -116.79 152.11 35.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.113 -0.494 . . . . 74.13 110.597 179.776 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.417 ' CG1' ' HD2' ' A' ' 16' ' ' ARG . 38.2 t -55.88 -32.74 33.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.264 -0.425 . . . . 64.24 110.928 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -72.33 -26.65 62.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.992 -0.549 . . . . 73.25 111.202 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.449 ' HB2' HG23 ' A' ' 11' ' ' THR . 17.3 mt-30 -82.19 -56.44 3.92 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.842 0.353 . . . . 65.32 111.056 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.689 HD13 HG13 ' A' ' 60' ' ' VAL . 1.3 mt -49.58 -65.43 0.57 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.301 -0.409 . . . . 62.4 111.328 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.558 ' HG3' HG11 ' A' ' 60' ' ' VAL . 4.7 mtp-105 -55.75 -25.09 39.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 73.32 111.356 -179.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.412 ' HB2' ' O ' ' A' ' 14' ' ' GLN . 0.1 OUTLIER -56.4 -179.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.01 0.434 . . . . 63.15 111.175 -179.799 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -109.41 16.76 22.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.937 -0.574 . . . . 60.41 111.108 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -114.51 -27.86 7.39 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.485 -0.325 . . . . 75.44 111.097 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.899 HD12 HD11 ' A' ' 25' ' ' ILE . 2.5 tm? -81.94 112.61 36.6 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.392 . . . . 53.11 110.954 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -60.66 123.34 12.82 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.52 2.146 . . . . 65.3 112.364 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -24.15 67.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 75.54 111.192 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -53.61 -40.53 65.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.886 0.374 . . . . 75.41 111.232 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.98 -52.5 14.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.092 -0.504 . . . . 71.42 110.728 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.899 HD11 HD12 ' A' ' 20' ' ' LEU . 42.8 mt -44.87 -30.74 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.707 -0.679 . . . . 73.2 111.295 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.795 ' HB ' HG23 ' A' ' 47' ' ' ILE . 7.3 mt -81.76 -55.2 8.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.053 0.454 . . . . 65.44 110.765 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.454 ' HG2' HD11 ' A' ' 47' ' ' ILE . 24.3 mttt -52.44 -27.12 14.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.687 -0.688 . . . . 74.42 110.935 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.454 ' CZ ' ' ND1' ' A' ' 32' ' ' HIS . 42.7 t80 -77.24 -48.63 17.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.075 -0.511 . . . . 72.3 110.969 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.792 HD21 ' HA ' ' A' ' 63' ' ' TYR . 6.3 mt -67.13 -26.44 66.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.859 -0.609 . . . . 74.23 111.336 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -75.3 -35.66 61.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.942 0.401 . . . . 73.44 110.717 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.424 ' HG3' ' CD2' ' A' ' 32' ' ' HIS . 14.9 pt-20 -87.63 -31.19 19.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 70.04 111.075 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.457 ' CE1' ' HB3' ' A' ' 6' ' ' PRO . 19.7 m170 -98.95 -9.02 24.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.289 -0.414 . . . . 75.31 111.571 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -109.86 155.65 15.98 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.719 -0.753 . . . . 63.24 112.318 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.3 p -97.3 153.11 18.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.562 0.22 . . . . 62.31 110.539 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.817 ' HA ' HD12 ' A' ' 38' ' ' LEU . 0.8 OUTLIER -42.89 -48.57 5.84 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.847 0.356 . . . . 72.31 111.371 -179.702 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.6 m -52.85 -50.89 62.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.123 -0.489 . . . . 60.25 110.507 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.759 ' CZ ' HD12 ' A' ' 66' ' ' LEU . 1.1 t80 -60.47 -31.95 70.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.623 -0.717 . . . . 73.33 110.355 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.817 HD12 ' HA ' ' A' ' 35' ' ' ASP . 5.9 mt -75.86 -54.75 6.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.004 -0.543 . . . . 65.24 111.307 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.78 ' HB2' HD11 ' A' ' 44' ' ' LEU . . . -50.02 -35.0 23.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.351 -0.386 . . . . 63.55 111.751 -179.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -72.64 -31.13 64.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.242 -0.435 . . . . 65.51 111.523 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 62' ' ' ALA . 1.8 m170 -109.91 10.33 24.39 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.734 0.272 . . . . 62.52 111.734 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.407 ' N ' ' O ' ' A' ' 38' ' ' LEU . 7.7 mmmt 58.43 35.63 24.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.745 0.307 . . . . 62.12 111.217 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.695 ' CB ' HD23 ' A' ' 38' ' ' LEU . 49.4 mt -90.96 -16.93 27.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.427 -0.352 . . . . 75.31 111.017 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.78 HD11 ' HB2' ' A' ' 39' ' ' ALA . 56.7 mt -50.76 170.46 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.042 0.449 . . . . 61.11 111.32 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.23 -155.94 29.04 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.927 -0.654 . . . . 63.41 112.951 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.887 ' O ' HG23 ' A' ' 50' ' ' VAL . 72.9 m-80 -100.57 141.88 32.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.968 0.413 . . . . 74.14 111.051 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.795 HG23 ' HB ' ' A' ' 26' ' ' ILE . 2.9 mp -45.31 -47.24 3.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.883 -0.598 . . . . 73.11 111.526 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mttm -51.61 -41.58 61.34 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.983 -0.553 . . . . 61.21 111.065 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -85.7 -28.35 24.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.013 -0.54 . . . . 73.33 111.113 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 46' ' ' ASN . 21.3 t -74.0 -27.72 22.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.278 -0.419 . . . . 75.52 111.535 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.45 -24.1 67.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.386 -0.37 . . . . 73.43 111.434 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -95.24 -27.3 15.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.341 -0.391 . . . . 71.51 111.28 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.7 m -84.19 -24.38 30.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.362 -0.381 . . . . 72.24 111.403 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -116.57 132.7 56.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.842 0.354 . . . . 50.55 111.31 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -79.71 -178.61 6.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.126 -0.488 . . . . 72.31 110.409 179.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.72 ' O ' HG23 ' A' ' 60' ' ' VAL . 22.8 mmmt -60.96 -58.46 8.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.788 0.328 . . . . 73.34 110.494 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.29 -30.18 71.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.211 -0.45 . . . . 75.14 110.512 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.35 -39.64 80.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.5 . . . . 71.45 110.443 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.595 HD21 HG12 ' A' ' 26' ' ' ILE . 30.5 mt -79.36 -27.36 41.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.588 -0.733 . . . . 53.35 111.022 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.72 HG23 ' O ' ' A' ' 56' ' ' LYS . 10.9 t -79.9 -44.26 22.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.969 0.414 . . . . 63.51 110.774 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 79.2 m -60.61 -35.8 77.02 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.896 -0.593 . . . . 63.15 110.236 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.428 ' HA ' ' CE1' ' A' ' 41' ' ' HIS . . . -78.7 -23.19 45.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.855 -0.611 . . . . 50.13 110.774 179.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.792 ' HA ' HD21 ' A' ' 29' ' ' LEU . 83.2 t80 -82.97 -22.74 33.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.086 -0.506 . . . . 75.41 111.016 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.434 ' ND2' HG12 ' A' ' 60' ' ' VAL . 39.0 m-80 -85.47 -53.73 5.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 75.44 111.242 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.495 ' HD2' HG21 ' A' ' 69' ' ' THR . 0.1 OUTLIER -63.33 -24.35 67.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.008 -0.542 . . . . 63.45 111.408 -179.427 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.759 HD12 ' CZ ' ' A' ' 37' ' ' PHE . 6.3 tt -56.06 -39.1 71.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.92 0.39 . . . . 75.41 110.904 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.402 ' CE2' ' O ' ' A' ' 6' ' ' PRO . 4.4 m-85 -77.85 -40.69 39.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.975 -0.557 . . . . 64.11 110.613 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -66.37 -37.73 85.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.542 . . . . 65.24 110.711 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.495 HG21 ' HD2' ' A' ' 65' ' ' HIS . 75.5 p -91.13 -7.25 52.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.964 -0.562 . . . . 74.13 111.329 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.8 mtmt 51.21 35.43 13.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.739 0.304 . . . . 61.41 111.438 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 41.9 mtt-85 -91.93 44.4 1.17 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.374 -0.375 . . . . 73.42 111.146 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.403 ' CE2' ' HD2' ' A' ' 6' ' ' PRO . 88.9 m-85 -65.72 176.53 1.51 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.288 -0.414 . . . . 74.41 110.701 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -77.11 134.38 38.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 74.24 110.897 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -112.22 -146.24 10.02 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.738 -0.744 . . . . 71.05 112.454 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.5 t -100.01 147.63 25.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.812 0.339 . . . . 71.22 110.865 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -110.05 -33.43 6.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.445 . . . . 73.43 110.908 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.461 ' O ' HG23 ' A' ' 78' ' ' ILE . 11.4 t -173.74 129.0 0.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 70.15 110.919 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.461 HG23 ' O ' ' A' ' 77' ' ' SER . 2.5 pp -157.26 146.25 10.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 74.5 111.09 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.4 m 60.31 -169.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 75.03 110.876 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.97 101.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 74.52 110.883 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.9 p -109.22 -31.08 2.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.45 . . . . 54.43 111.098 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 53.1 p -60.76 -41.99 96.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 74.42 110.895 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 63.64 138.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.218 -0.446 . . . . 72.3 110.914 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 60.72 111.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.471 . . . . 52.54 110.918 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.4 t -127.93 130.25 69.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 75.44 111.129 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.66 -51.58 4.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.46 . . . . 62.13 110.869 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -177.48 -39.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 70.13 110.889 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 28.9 t -66.97 107.04 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.076 -0.511 . . . . 75.23 111.036 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 6.7 tptt -136.22 88.73 2.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 63.2 110.901 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.2 mp -88.49 164.09 15.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 72.4 110.897 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 60.44 107.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 72.41 110.902 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.79 -32.79 21.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 74.43 110.898 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -102.66 101.09 11.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 74.22 110.887 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.2 tttm -105.82 87.48 2.36 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 61.11 110.931 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -69.79 165.83 29.68 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.595 2.197 . . . . 65.1 112.293 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.24 128.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 73.23 110.946 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 61.02 31.91 19.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 60.54 110.929 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 5.6 m -163.73 105.08 0.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 71.32 110.911 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.3 mttt 60.55 172.92 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 74.22 110.914 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.1 p -152.78 147.22 25.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 64.05 110.871 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -96.55 -32.54 12.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 71.43 110.888 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 60.34 164.29 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 71.33 110.877 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 2.5 p -146.6 122.64 10.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 63.3 110.88 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 7.1 mt -95.21 134.05 38.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 72.52 110.918 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -93.32 179.46 5.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 75.42 110.884 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 63.71 -80.15 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.179 -0.464 . . . . 74.13 110.996 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 148.35 66.9 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.872 -0.68 . . . . 53.05 112.532 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.88 170.81 15.84 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.577 2.185 . . . . 73.42 112.306 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.07 -167.65 0.18 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.596 2.197 . . . . 64.24 112.29 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 196' ' ' TRP . 0.0 OUTLIER -100.76 29.9 4.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 64.11 110.955 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -154.82 167.33 30.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.285 -0.416 . . . . 73.42 111.015 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 82.0 m -136.72 103.52 5.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.016 -0.538 . . . . 75.51 110.725 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 190' ' ' LEU . 21.5 ptmt -108.14 151.45 25.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.948 0.404 . . . . 73.35 111.196 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.434 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.4 OUTLIER -142.49 123.16 14.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.952 -0.567 . . . . 74.32 110.547 179.829 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.609 ' O ' HG13 ' A' ' 115' ' ' VAL . 9.1 p -77.56 106.24 7.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.284 -0.417 . . . . 72.11 111.173 -179.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.5 HD22 ' N ' ' A' ' 116' ' ' LEU . 3.5 mm? -77.73 -42.18 35.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 71.13 110.855 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 9.3 tttm -130.46 108.18 9.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 65.14 110.962 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 138.28 57.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 72.0 110.844 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.503 ' HA3' ' HB2' ' A' ' 186' ' ' GLU . . . -109.22 -156.19 17.01 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.631 -0.795 . . . . 75.22 112.645 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -36.53 -51.21 0.83 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.919 0.39 . . . . 73.4 111.651 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 66.99 34.58 5.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.836 -0.62 . . . . 75.55 110.296 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 55.1 m -151.88 -44.06 0.11 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.697 -0.683 . . . . 72.14 110.66 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -91.5 92.65 8.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 73.53 110.903 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -100.74 153.66 37.61 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 73.03 110.791 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.601 ' HB2' HG21 ' A' ' 166' ' ' VAL . 59.5 Cg_endo -71.88 125.55 11.12 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.52 2.147 . . . . 70.31 112.443 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.0 mtmm -95.54 156.9 16.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.113 -0.494 . . . . 73.24 110.956 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 3.8 mttp -57.88 118.71 5.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 74.33 110.865 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 99.24 -23.44 36.29 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.643 -0.789 . . . . 74.33 112.507 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.414 ' O ' HG22 ' A' ' 166' ' ' VAL . 3.5 m-20 -78.6 136.91 37.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.746 0.308 . . . . 73.11 110.738 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.599 ' HA ' ' HA ' ' A' ' 165' ' ' LYS . 17.1 m -73.12 173.46 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.107 0.479 . . . . 63.42 111.655 -179.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.683 HG12 HG23 ' A' ' 223' ' ' ILE . 19.4 m -156.78 145.87 11.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.507 -0.769 . . . . 73.31 110.568 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.444 ' CD2' ' N ' ' A' ' 132' ' ' HIS . 0.3 OUTLIER -126.16 117.72 23.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.639 0.257 . . . . 74.13 110.454 179.506 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.436 ' HB3' ' HA ' ' A' ' 220' ' ' LEU . 31.9 p -150.8 169.91 20.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.104 0.478 . . . . 54.31 111.512 -179.225 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.511 ' O ' HG13 ' A' ' 218' ' ' VAL . 85.6 m95 -101.88 156.35 17.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.559 -0.746 . . . . 73.14 109.531 179.246 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.569 ' H ' HD11 ' A' ' 149' ' ' ILE . 31.8 p90 -161.27 137.66 8.34 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 120.314 -0.554 . . . . 74.21 112.304 -179.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.954 HG21 HG11 ' A' ' 5' ' ' VAL . 12.8 m -127.88 111.56 13.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.485 -0.779 . . . . 62.04 110.195 179.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . 0.555 ' HA2' ' HB3' ' A' ' 216' ' ' PHE . . . -96.52 145.54 17.88 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.577 -0.821 . . . . 74.01 113.13 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.738 ' OG1' HG23 ' A' ' 5' ' ' VAL . 0.6 OUTLIER -150.71 153.02 34.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.8 0.334 . . . . 62.14 110.893 179.834 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.618 HD12 ' HB ' ' A' ' 143' ' ' THR . 69.5 mt -92.07 179.23 5.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.01 110.757 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . 0.525 ' HA ' ' HB2' ' A' ' 3' ' ' ALA . 5.9 mm-40 -57.04 -44.4 82.9 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.961 0.41 . . . . 73.35 110.996 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.01 -8.54 56.8 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.968 -0.56 . . . . 70.53 111.313 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 95.94 25.81 12.47 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.644 -0.789 . . . . 54.44 112.523 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . 0.618 ' HB ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -93.89 112.59 24.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.836 0.35 . . . . 72.31 110.777 179.977 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.434 HG12 HG23 ' A' ' 138' ' ' THR . 4.6 m -63.7 135.08 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 73.03 111.142 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.463 ' HB2' HD11 ' A' ' 208' ' ' ILE . 39.9 p90 -116.27 -39.39 3.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.49 . . . . 72.14 110.882 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -143.41 110.3 5.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.042 -0.526 . . . . 72.52 110.751 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.453 ' CG2' HG23 ' A' ' 136' ' ' THR . 67.3 m -142.82 107.57 4.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 73.42 111.138 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -97.74 35.42 1.69 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 73.25 110.477 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.569 HD11 ' H ' ' A' ' 135' ' ' TYR . 20.2 mm -100.79 104.49 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.08 -0.509 . . . . 72.44 111.095 -179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -107.32 -79.27 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 72.44 110.946 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 3.1 p -146.56 166.02 27.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.33 -0.395 . . . . 73.05 110.953 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.81 166.78 22.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.456 . . . . 74.12 110.878 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -80.91 -31.21 35.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 71.15 111.127 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.8 ttpt -63.85 -33.43 75.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 74.33 110.937 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.1 mttm -75.31 -32.99 61.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 75.3 110.884 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 5.5 tptt -172.69 167.91 5.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.248 -0.433 . . . . 64.35 110.872 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -99.48 30.62 3.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 72.4 110.992 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 21.4 m-20 -113.24 31.23 6.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.476 . . . . 71.34 110.86 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -157.22 129.84 7.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 74.11 111.056 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 6.5 mttm -146.38 149.53 37.97 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 63.31 110.959 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.07 155.73 68.16 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.603 2.202 . . . . 73.04 112.223 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.66 123.64 24.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 72.01 110.692 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.655 ' HA ' ' O ' ' A' ' 131' ' ' VAL . 0.5 OUTLIER -104.81 124.5 49.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.895 0.378 . . . . 64.25 111.083 179.866 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' PHE . . . . . 0.713 ' HZ ' HD12 ' A' ' 179' ' ' LEU . 16.3 p90 -151.26 142.14 22.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 75.13 110.906 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.599 ' HA ' ' HA ' ' A' ' 130' ' ' VAL . 33.0 mttt -74.24 133.75 42.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.431 . . . . 73.35 111.174 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . 0.601 HG21 ' HB2' ' A' ' 125' ' ' PRO . 35.0 m -87.76 149.35 4.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.863 -0.608 . . . . 74.54 111.085 -179.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 69.28 22.07 76.08 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.777 -0.725 . . . . 74.0 112.608 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.588 HG21 ' CB ' ' A' ' 165' ' ' LYS . 11.8 m -132.38 44.16 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.904 0.383 . . . . 60.33 111.059 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . 44.17 36.36 4.02 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.171 -0.537 . . . . 51.2 113.223 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.59 -47.1 14.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.96 0.409 . . . . 53.31 110.881 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . 0.42 HG22 ' CE1' ' A' ' 164' ' ' PHE . 0.0 OUTLIER -119.37 -178.66 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.98 -0.554 . . . . 73.11 110.895 179.778 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' ILE . . . . . 0.564 ' CG1' ' HB2' ' A' ' 175' ' ' TRP . 4.2 pt -58.16 159.58 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.333 -0.394 . . . . 72.34 111.143 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -68.56 -29.61 68.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.347 -0.388 . . . . 75.44 111.152 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . -72.57 -38.39 57.55 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.542 -0.837 . . . . 73.34 111.888 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 175' ' ' TRP . . . . . 0.608 ' HE1' HG21 ' A' ' 218' ' ' VAL . 2.0 t90 -77.65 -32.54 53.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.865 0.365 . . . . 75.45 110.94 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -62.61 -34.46 77.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.08 -0.509 . . . . 53.32 110.305 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -78.41 -29.86 47.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.993 -0.549 . . . . 71.31 110.679 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . 0.538 ' CB ' HD13 ' A' ' 190' ' ' LEU . . . -78.78 -59.07 2.93 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.163 -0.472 . . . . 73.31 111.293 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.713 HD12 ' HZ ' ' A' ' 164' ' ' PHE . 4.6 mt -57.83 -30.78 66.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.986 -0.552 . . . . 75.42 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 180' ' ' LEU . . . . . 0.413 ' HA ' ' HG2' ' A' ' 125' ' ' PRO . 34.4 tp -59.47 -31.01 68.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.39 -0.368 . . . . 73.13 110.84 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.86 1.78 56.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 63.11 111.358 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.48 150.43 36.66 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.834 0.349 . . . . 71.35 110.927 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.57 165.63 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.248 -0.433 . . . . 71.34 111.22 -179.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . 0.751 ' HA ' HD22 ' A' ' 220' ' ' LEU . 0.7 OUTLIER -61.03 117.93 6.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.998 -0.546 . . . . 64.42 110.764 179.859 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 185' ' ' GLY . . . . . 0.405 ' O ' ' CA ' ' A' ' 119' ' ' GLY . . . 69.35 65.95 2.42 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.678 -0.772 . . . . 70.54 112.272 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . 0.503 ' HB2' ' HA3' ' A' ' 119' ' ' GLY . 28.0 tt0 -144.48 145.09 31.68 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.62 0.248 . . . . 75.01 110.403 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt -118.63 137.02 53.57 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.21 -0.293 . . . . 71.42 110.21 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 188' ' ' ALA . . . . . . . . . . . . . . . -146.21 173.79 11.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.18 0.514 . . . . 71.41 111.966 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 189' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.73 125.32 22.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.479 -0.782 . . . . 72.04 109.607 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . 0.538 HD13 ' CB ' ' A' ' 178' ' ' ALA . 1.7 pt? -137.2 143.13 42.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.274 0.559 . . . . 52.1 112.352 -179.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 191' ' ' GLU . . . . . 0.857 ' HG2' HG23 ' A' ' 215' ' ' THR . 6.6 mt-10 -117.13 111.01 18.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.289 -0.868 . . . . 74.45 109.862 179.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 192' ' ' ILE . . . . . 0.449 HD12 HD11 ' A' ' 172' ' ' ILE . 23.5 mt -104.76 141.52 20.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.024 0.44 . . . . 72.21 111.657 -179.116 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -74.02 163.23 69.82 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.758 -0.656 . . . . 74.12 110.947 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 194' ' ' PRO . . . . . 0.437 ' HG3' ' N ' ' A' ' 212' ' ' ALA . 48.7 Cg_exo -56.33 -36.31 96.92 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.756 2.304 . . . . 72.13 112.382 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 195' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -57.26 -42.32 81.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.26 -0.427 . . . . 72.52 111.13 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 196' ' ' TRP . . . . . 0.445 ' CE2' ' HB2' ' A' ' 110' ' ' LYS . 20.2 m0 -97.58 36.92 1.43 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 74.15 110.933 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . 0.438 ' HA ' HG21 ' A' ' 172' ' ' ILE . . . -160.24 -79.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.989 -0.55 . . . . 73.41 110.587 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . 0.582 ' CD2' HD11 ' A' ' 214' ' ' LEU . 42.6 m-85 -105.86 -71.24 0.75 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 60.14 110.352 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 199' ' ' GLY . . . . . . . . . . . . . . . 139.19 178.13 16.16 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.831 -0.7 . . . . 74.14 112.818 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 200' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.27 -33.51 67.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.879 0.371 . . . . 72.32 110.86 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.13 -57.02 14.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.107 -0.497 . . . . 72.42 110.633 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 104.17 170.19 25.02 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.862 -0.685 . . . . 75.13 112.548 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 203' ' ' GLN . . . . . 0.603 ' CB ' HD12 ' A' ' 208' ' ' ILE . 2.5 mm-40 -106.48 85.69 1.86 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.726 0.298 . . . . 74.23 110.698 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -63.4 -21.74 71.35 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.572 2.182 . . . . 52.12 112.554 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -69.59 -42.28 74.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.877 0.37 . . . . 75.24 110.876 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -97.67 28.21 3.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.096 -0.502 . . . . 71.11 111.306 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 207' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 56.01 36.51 27.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.394 -0.366 . . . . 73.3 111.013 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 208' ' ' ILE . . . . . 0.603 HD12 ' CB ' ' A' ' 203' ' ' GLN . 40.9 mt -103.94 114.24 64.69 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.151 -0.477 . . . . 70.44 111.045 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 209' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.66 171.72 10.41 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.442 2.095 . . . . 74.25 112.364 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 210' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.96 128.62 14.25 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.607 2.205 . . . . 72.41 112.426 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 211' ' ' ASN . . . . . 0.418 ' HA ' ' HG2' ' A' ' 194' ' ' PRO . 16.9 m-80 64.26 69.79 0.51 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.127 -0.488 . . . . 71.13 111.0 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 212' ' ' ALA . . . . . 0.437 ' N ' ' HG3' ' A' ' 194' ' ' PRO . . . -127.85 124.91 38.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 65.54 111.493 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 213' ' ' LYS . . . . . 0.501 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.7 OUTLIER -65.19 153.94 39.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 74.55 110.365 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.582 HD11 ' CD2' ' A' ' 198' ' ' TYR . 8.5 mt -131.14 109.49 10.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.947 0.403 . . . . 71.24 111.842 -179.264 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 215' ' ' THR . . . . . 0.857 HG23 ' HG2' ' A' ' 191' ' ' GLU . 25.4 m -100.99 135.98 41.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 61.14 110.32 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 216' ' ' PHE . . . . . 0.555 ' HB3' ' HA2' ' A' ' 137' ' ' GLY . 21.1 p90 -153.96 173.46 15.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.112 0.482 . . . . 74.11 111.653 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 217' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -132.61 136.37 46.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.637 -0.71 . . . . 72.13 110.426 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 218' ' ' VAL . . . . . 0.608 HG21 ' HE1' ' A' ' 175' ' ' TRP . 2.1 t -123.83 151.49 28.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.07 0.462 . . . . 72.43 111.968 -178.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -136.83 110.71 8.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.696 -0.683 . . . . 72.24 110.292 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 220' ' ' LEU . . . . . 0.751 HD22 ' HA ' ' A' ' 184' ' ' LYS . 1.7 tt -70.05 131.08 43.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 72.02 111.102 -179.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 221' ' ' VAL . . . . . 0.41 HG23 ' HA ' ' A' ' 133' ' ' CYS . 20.1 t -110.34 -29.21 2.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.112 -0.494 . . . . 75.53 111.452 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 222' ' ' ASP . . . . . 0.413 ' N ' HD23 ' A' ' 220' ' ' LEU . 4.1 t70 -170.81 161.31 7.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.917 0.389 . . . . 74.42 111.069 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 223' ' ' ILE . . . . . 0.716 HG13 HD21 ' A' ' 220' ' ' LEU . 42.3 mt -141.02 111.01 3.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.078 -0.51 . . . . 73.33 111.116 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 224' ' ' ASP . . . . . 0.417 ' C ' HG22 ' A' ' 130' ' ' VAL . 1.5 t70 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 74.2 110.907 -179.991 . . . . . . . . 1 1 . 1 stop_ save_