data_1w09_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 1w09 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 mtpt . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.639 0.257 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.61 -44.45 82.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.196 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.2 tp -60.04 -45.1 93.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.783 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 43.6 mm -60.49 -54.23 38.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.878 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.8 m -51.92 -33.06 35.49 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.869 0.366 . . . . 0.0 110.697 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.76 -44.42 77.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.241 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.437 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -69.2 -28.22 72.97 Favored Glycine 0 N--CA 1.451 -0.365 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 177.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -70.08 -61.37 1.8 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.52 -0.84 . . . . 0.0 110.253 179.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.8 ttpm? -59.3 -36.07 74.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.985 0.421 . . . . 0.0 110.086 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -60.58 -49.39 77.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.275 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.499 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -71.26 -49.31 44.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.391 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.3 m -55.36 -51.55 66.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.966 0.413 . . . . 0.0 110.802 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.445 ' O ' ' CB ' ' A' ' 24' ' ' GLN . 46.3 t -66.45 -34.95 73.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.065 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.45 HD23 ' CD2' ' A' ' 44' ' ' TRP . 0.5 OUTLIER -65.88 -46.21 79.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.641 0.258 . . . . 0.0 111.199 -179.741 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.509 ' CD2' ' CD2' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -64.38 -40.91 96.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.951 0.405 . . . . 0.0 110.358 179.857 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -82.78 -17.25 44.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.149 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.445 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -105.35 6.98 33.13 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.851 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -50.77 162.23 0.28 Allowed 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 177.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.7 p -108.24 133.87 51.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 119.322 0.965 . . . . 0.0 110.868 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.454 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.6 m-85 . . . . . 0 C--N 1.327 -0.378 0 CA-C-O 121.312 0.577 . . . . 0.0 110.937 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.485 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 3.6 mp . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 120.9 0.381 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.409 ' CG2' ' HB3' ' A' ' 36' ' ' ASP . 1.9 p -78.0 146.31 8.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.598 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.1 m -79.76 172.45 13.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.19 0.519 . . . . 0.0 111.809 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -64.63 -44.4 90.62 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.841 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -34.49 77.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.185 0.517 . . . . 0.0 110.514 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.409 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 9.2 t70 -72.22 -38.18 69.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.021 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 2.0 tpt -67.81 -43.05 80.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.671 178.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.5 t -57.97 -47.27 87.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.479 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -59.59 -46.98 87.35 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.858 0.361 . . . . 0.0 110.092 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 40.6 t -58.75 -45.06 91.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.515 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.1 t -61.9 -48.57 87.96 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.383 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -58.27 -46.42 86.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.312 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.581 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -57.99 -45.6 86.53 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.076 179.175 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.45 ' CD2' HD23 ' A' ' 21' ' ' LEU . 10.9 m0 -60.21 -39.54 86.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.217 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.415 ' HG3' ' CD1' ' A' ' 74' ' ' LEU . 27.4 ttm -71.2 -43.95 66.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.784 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -73.66 -36.45 65.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.984 0.421 . . . . 0.0 110.022 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.581 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.22 -44.59 94.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.053 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -69.77 -43.67 71.7 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.944 0.402 . . . . 0.0 110.459 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.478 ' O ' ' CG ' ' A' ' 53' ' ' ARG . 9.8 mm -54.66 -55.72 14.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.452 ' HA ' ' HG3' ' A' ' 53' ' ' ARG . 11.3 t30 -62.07 -36.63 82.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.337 0.589 . . . . 0.0 110.373 179.316 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.492 ' HB2' ' O ' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -57.75 -48.53 79.36 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.332 179.72 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.45 ' O ' HG23 ' A' ' 56' ' ' VAL . 23.1 m-85 -75.63 -30.36 59.47 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.49 ' HG2' ' HG ' ' A' ' 67' ' ' LEU . 0.1 OUTLIER -62.77 -28.06 69.72 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.146 179.278 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -97.11 -15.8 20.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.02 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.463 ' HG3' ' CD1' ' A' ' 51' ' ' TYR . 12.2 mm-40 -102.71 45.19 0.97 Allowed 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.493 ' HB ' ' HD3' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -120.83 163.73 18.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.028 0.442 . . . . 0.0 111.144 179.22 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.02 171.6 14.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.565 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 81.19 -156.06 37.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.264 -0.969 . . . . 0.0 113.06 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -68.69 156.96 89.82 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.851 0.358 . . . . 0.0 111.235 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.85 -23.34 41.52 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.674 2.249 . . . . 0.0 112.9 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -65.05 -44.07 90.22 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.84 0.352 . . . . 0.0 111.461 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -64.54 -42.77 95.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.079 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.554 ' O ' HD11 ' A' ' 67' ' ' LEU . 15.8 mtt180 -53.77 -52.34 60.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -57.04 -42.18 80.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.866 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.6 -31.86 72.76 Favored 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.55 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.431 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -72.82 -40.8 65.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.493 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.554 HD11 ' O ' ' A' ' 63' ' ' ARG . 0.6 OUTLIER -70.5 -35.87 73.47 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.556 -179.59 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.405 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 15.5 pt20 -72.82 -47.62 44.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.995 0.426 . . . . 0.0 110.272 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 73' ' ' GLU . 12.3 mt-10 -61.96 -36.57 81.84 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.271 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.438 HD12 ' CD2' ' A' ' 52' ' ' TYR . 0.2 OUTLIER -64.71 -48.41 74.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.722 0.296 . . . . 0.0 110.253 179.087 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.7 ttt-85 -54.55 -43.45 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -31.78 65.09 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.448 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 4.3 tp10 -62.46 -49.48 75.27 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.128 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.434 HD21 ' CD2' ' A' ' 18' ' ' PHE . 14.0 mt -67.87 -44.7 76.45 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.053 0.454 . . . . 0.0 110.524 178.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.38 -39.65 61.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.694 -179.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.426 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 27.7 m -80.91 -50.67 9.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.737 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.415 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 1.1 mt -55.8 -33.99 64.9 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.152 -179.185 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.85 -30.93 61.51 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.3 0.481 . . . . 0.0 112.3 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.543 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 4.8 m-20 -51.72 -50.24 78.62 Favored Pre-proline 0 C--N 1.328 -0.326 0 N-CA-C 111.811 0.301 . . . . 0.0 111.811 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 51.3 Cg_endo -69.65 -36.24 11.47 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.444 2.096 . . . . 0.0 113.092 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.509 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 3.4 t80 -62.99 -53.79 48.38 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.044 0.449 . . . . 0.0 110.514 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 59.6 mt -54.96 -31.85 60.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.769 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.81 -44.78 72.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.394 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 80' ' ' PRO . 6.0 mttm -57.39 -43.33 83.55 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.077 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -74.14 -33.53 63.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.997 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -45.71 93.65 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.08 -33.0 71.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.623 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.485 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 30.5 t80 -67.42 -29.06 68.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.173 179.066 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.613 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 tttp . . . . . 0 N--CA 1.456 -0.139 0 CA-C-O 120.642 0.258 . . . . 0.0 111.086 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.88 -44.51 92.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.836 0.35 . . . . 0.0 110.268 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.3 tp -61.01 -45.79 93.36 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.144 0.497 . . . . 0.0 109.837 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 11.9 mt -60.39 -53.68 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.013 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.2 p -54.31 -33.05 57.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.64 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.89 -41.45 82.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.75 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.498 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -70.24 -42.48 66.24 Favored Glycine 0 C--O 1.227 -0.316 0 N-CA-C 109.113 -1.595 . . . . 0.0 109.113 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -54.41 -58.27 8.08 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 113.822 -1.189 . . . . 0.0 109.221 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.462 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -60.38 -29.43 68.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.503 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.462 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -68.82 -46.44 68.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.437 179.616 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.565 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -71.83 -46.43 58.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.821 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 79.0 p -55.43 -51.52 66.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.02 0.438 . . . . 0.0 110.366 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.417 ' O ' ' N ' ' A' ' 24' ' ' GLN . 77.5 t -67.16 -31.11 51.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.564 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.421 HD23 ' CE3' ' A' ' 44' ' ' TRP . 18.0 tp -64.27 -46.38 83.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.895 0.379 . . . . 0.0 110.237 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 9.4 mt -66.26 -36.61 83.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.256 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.61 -17.41 44.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.386 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.417 ' N ' ' O ' ' A' ' 20' ' ' VAL . 0.4 OUTLIER -111.81 6.46 19.67 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -179.066 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.425 ' OE1' ' CE1' ' A' ' 81' ' ' PHE . 0.0 OUTLIER -48.56 162.59 0.09 Allowed 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 177.594 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 23.5 t -110.66 134.33 53.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 119.592 1.087 . . . . 0.0 110.23 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.42 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 13.4 m-85 . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 121.652 0.739 . . . . 0.0 110.916 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.499 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.4 mp . . . . . 0 C--O 1.231 0.082 0 CA-C-O 121.193 0.52 . . . . 0.0 111.967 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 9.9 p -77.69 155.98 5.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.729 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.85 171.7 14.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.124 0.488 . . . . 0.0 111.725 -178.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -31.68 68.19 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.648 -179.271 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -67.07 -37.01 83.25 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.238 0.542 . . . . 0.0 110.182 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.65 -34.71 67.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.465 178.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 2.6 tpt -67.78 -46.1 72.98 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.45 178.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.8 t -55.83 -47.99 78.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.303 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.06 -46.72 84.95 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.896 0.379 . . . . 0.0 110.027 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.8 t -57.22 -47.5 84.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.577 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 32.8 t -61.37 -47.97 91.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.554 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -56.36 -48.53 76.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.505 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.569 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 1.8 m-20 -60.04 -45.07 94.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.681 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.421 ' CE3' HD23 ' A' ' 21' ' ' LEU . 13.1 m0 -60.72 -42.48 97.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.087 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 39.8 mtm -66.63 -48.74 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -178.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -70.48 -32.84 70.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.977 0.418 . . . . 0.0 110.063 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.569 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -62.75 -42.6 99.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.043 179.338 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.472 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 6.3 m-85 -69.82 -44.81 69.22 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.335 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -57.34 -55.29 21.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.937 0.399 . . . . 0.0 110.758 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -66.4 -41.19 89.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.906 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.492 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 5.0 t80 -60.43 -46.0 91.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.367 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.501 ' CD2' ' CD2' ' A' ' 70' ' ' LEU . 25.9 m-85 -70.19 -31.29 68.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.738 -0.664 . . . . 0.0 112.184 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.433 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . 34.5 ttm-85 -59.12 -27.96 66.09 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.684 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -94.99 -17.93 21.51 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.498 ' HG2' ' HA ' ' A' ' 52' ' ' TYR . 5.5 pt20 -105.54 45.13 0.98 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.51 ' HB ' ' HG3' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -124.1 163.5 23.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.525 178.792 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.4 m -127.07 166.45 17.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.441 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 91.6 -149.79 19.99 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.715 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -80.63 157.02 72.73 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.804 0.335 . . . . 0.0 111.005 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.72 -19.75 47.11 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.874 2.383 . . . . 0.0 113.479 -179.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -66.2 -43.98 85.21 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.891 0.376 . . . . 0.0 111.446 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -66.7 -35.43 80.11 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.181 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.51 ' HG3' ' HB ' ' A' ' 56' ' ' VAL . 2.2 mpt_? -59.48 -50.96 71.91 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -58.44 -41.64 85.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.548 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -49.67 73.9 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.262 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.472 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.13 -33.76 67.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.269 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.433 ' CD2' ' HB2' ' A' ' 53' ' ' ARG . 4.2 mp -69.68 -34.28 73.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.279 179.073 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.517 ' HA ' ' HG2' ' A' ' 71' ' ' ARG . 0.8 OUTLIER -74.43 -48.75 25.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.559 179.506 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.438 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 7.2 mm-40 -63.28 -30.34 71.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.875 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.501 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 1.4 tp -73.65 -48.4 32.65 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.686 -0.406 . . . . 0.0 109.945 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.517 ' HG2' ' HA ' ' A' ' 68' ' ' GLN . 6.7 ptp180 -56.88 -38.48 72.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.441 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.504 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 3.1 pt20 -75.03 -36.0 61.9 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.287 0.565 . . . . 0.0 109.51 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -62.63 -42.17 99.43 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.397 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.437 HD22 ' CD2' ' A' ' 18' ' ' PHE . 37.6 mt -67.86 -45.21 75.22 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.126 0.489 . . . . 0.0 110.009 178.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -53.78 -38.65 64.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.137 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.7 -34.53 34.54 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.059 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.419 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 3.4 mt -74.5 -28.15 60.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.046 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.08 -29.82 60.77 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.551 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.1 m120 -54.69 -50.19 87.12 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.551 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 45.1 Cg_endo -68.74 -37.04 12.75 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.403 2.069 . . . . 0.0 112.81 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.528 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 1.5 t80 -63.94 -52.61 58.96 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.087 0.47 . . . . 0.0 110.254 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 60.0 mt -57.04 -28.13 62.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.721 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.97 -46.73 61.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.905 0.383 . . . . 0.0 110.369 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.9 mmmt -57.09 -43.09 81.86 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.296 179.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -76.05 -33.32 59.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.62 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 40.8 mtt180 -64.87 -42.37 94.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.065 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.59 -34.32 67.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.268 0.556 . . . . 0.0 109.73 178.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.499 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 6.9 t80 -71.04 -28.71 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.627 179.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.083 179.033 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.6 pttm . . . . . 0 N--CA 1.456 -0.162 0 CA-C-O 120.705 0.288 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.94 -44.57 89.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.343 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 tp -61.99 -43.79 98.1 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.6 mt -61.35 -54.36 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.463 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -55.45 -43.05 75.07 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.424 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.471 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -58.86 -43.36 90.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.851 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.667 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -69.83 -28.32 72.11 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 177.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.463 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.3 OUTLIER -65.41 -61.33 2.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.095 -1.053 . . . . 0.0 110.322 179.053 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.442 ' HG3' ' O ' ' A' ' 12' ' ' SER . 1.1 mtpt -58.0 -38.46 76.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.203 0.525 . . . . 0.0 109.932 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.6 tt0 -56.57 -49.57 74.46 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.279 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.566 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.7 OUTLIER -71.41 -50.58 30.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.553 -179.481 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -51.75 67.0 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.05 0.452 . . . . 0.0 110.776 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.451 ' O ' ' HB3' ' A' ' 24' ' ' GLN . 48.9 t -64.19 -35.64 74.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.625 179.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.444 ' HA ' ' HG3' ' A' ' 24' ' ' GLN . 0.3 OUTLIER -66.27 -45.87 79.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.688 0.28 . . . . 0.0 110.911 -179.855 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 11.1 mt -60.43 -40.26 90.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.885 0.374 . . . . 0.0 110.309 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.57 -21.93 35.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.938 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.462 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.4 OUTLIER -108.91 21.53 17.11 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.753 -179.432 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.664 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -71.07 33.24 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -179.296 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.664 ' O ' ' O ' ' A' ' 25' ' ' GLN . 21.9 t 24.86 120.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 179.045 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 . . . . . 0 C--N 1.329 -0.301 0 CA-C-O 121.023 0.439 . . . . 0.0 110.573 178.678 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.2 mt . . . . . 0 N--CA 1.456 -0.145 0 CA-C-O 121.021 0.439 . . . . 0.0 111.317 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.446 ' CG2' ' HB3' ' A' ' 36' ' ' ASP . 15.0 p -79.94 150.25 5.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.386 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.3 m -79.65 172.92 13.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.153 0.501 . . . . 0.0 111.632 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.4 ' O ' ' CG2' ' A' ' 38' ' ' VAL . 1.2 tm-20 -67.52 -42.62 82.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.904 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -67.92 -37.79 82.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.19 0.519 . . . . 0.0 110.599 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.446 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 9.0 t0 -67.96 -37.76 81.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.353 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.44 ' HG2' ' CD2' ' A' ' 85' ' ' TYR . 6.4 tpt -68.43 -39.9 81.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.733 178.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.4 ' CG2' ' O ' ' A' ' 34' ' ' GLU . 92.6 t -56.77 -45.71 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.682 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -46.21 91.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.937 178.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.494 ' HA ' ' OD2' ' A' ' 43' ' ' ASP . 37.0 t -55.46 -48.34 77.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.791 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.7 t -67.87 -41.35 84.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.925 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -43.68 79.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.105 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.564 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 2.8 p30 -71.54 -38.62 71.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.246 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.413 ' CZ3' HD22 ' A' ' 21' ' ' LEU . 6.6 m0 -60.98 -41.34 96.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.019 0.438 . . . . 0.0 110.474 178.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 47.8 mtm -71.01 -40.81 71.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.783 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -73.39 -35.21 65.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.028 0.442 . . . . 0.0 110.138 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.564 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -65.44 -42.0 92.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.207 179.603 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.444 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 4.5 m-85 -69.2 -44.39 72.24 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.738 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.543 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -54.39 -54.33 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.321 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.566 ' HA ' ' HG3' ' A' ' 53' ' ' ARG . 20.6 t30 -61.64 -36.75 81.7 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 121.367 0.603 . . . . 0.0 109.886 178.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.423 ' HB2' ' O ' ' A' ' 47' ' ' PHE . 1.1 t80 -59.04 -43.98 91.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.91 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.667 ' OH ' ' HA2' ' A' ' 14' ' ' GLY . 30.2 m-85 -75.36 -30.67 60.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.566 ' HG3' ' HA ' ' A' ' 50' ' ' ASN . 15.5 mtp85 -60.85 -31.26 70.71 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.63 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -93.36 -13.08 28.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.396 -178.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -107.15 39.99 1.76 Allowed 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.711 ' HB ' ' HD3' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -118.06 153.69 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.298 178.555 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.44 171.54 9.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.365 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.97 -152.93 25.13 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.954 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -73.66 161.34 79.24 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-O 120.727 0.299 . . . . 0.0 110.991 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.76 -25.1 40.04 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.53 2.153 . . . . 0.0 112.671 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -43.87 81.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.858 0.361 . . . . 0.0 111.138 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -66.65 -44.38 82.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.408 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.711 ' HD3' ' HB ' ' A' ' 56' ' ' VAL . 11.4 mtt85 -53.65 -51.45 63.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.14 -41.73 84.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.969 -179.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.443 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 8.5 tttp -64.22 -31.12 72.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.946 0.403 . . . . 0.0 110.86 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.85 -34.76 64.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.984 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.508 HD11 ' N ' ' A' ' 67' ' ' LEU . 3.6 mp -71.71 -36.56 70.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.361 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 6.4 pt20 -71.81 -46.49 58.01 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.402 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.0 OUTLIER -62.78 -33.82 75.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.931 178.936 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.499 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 1.5 mm? -64.3 -49.33 72.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.774 179.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.9 tpp85 -55.34 -47.43 75.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.653 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.15 -36.28 79.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.324 0.583 . . . . 0.0 109.658 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -60.96 -42.54 98.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.723 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.424 HD21 ' CE2' ' A' ' 18' ' ' PHE . 6.3 mt -67.74 -45.1 75.96 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.215 0.531 . . . . 0.0 109.954 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -52.53 -38.92 60.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.944 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.407 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 3.0 m -80.78 -50.61 9.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.79 -37.76 66.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.057 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.36 -27.84 59.31 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.543 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.7 t-20 -51.62 -50.02 79.55 Favored Pre-proline 0 CA--C 1.533 0.289 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.6 Cg_endo -69.09 -32.61 20.98 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.304 2.002 . . . . 0.0 113.082 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.502 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 10.6 t80 -64.66 -53.72 42.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.913 0.387 . . . . 0.0 110.905 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.3 mt -54.89 -37.82 66.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.185 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.36 -45.65 83.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.803 0.335 . . . . 0.0 110.591 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -58.17 -40.74 82.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.775 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.44 ' CD2' ' HG2' ' A' ' 37' ' ' MET . 0.3 OUTLIER -73.82 -33.62 64.23 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.752 179.849 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -43.45 98.81 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -72.68 -31.42 65.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.055 178.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -72.46 -29.08 63.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.905 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.42 HD22 ' CD2' ' A' ' 85' ' ' TYR . 3.0 mm? . . . . . 0 C--N 1.33 -0.28 0 CA-C-O 121.257 0.551 . . . . 0.0 110.067 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.6 mmtp . . . . . 0 N--CA 1.456 -0.136 0 CA-C-O 120.769 0.318 . . . . 0.0 110.636 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.69 -45.12 68.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.499 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.2 -43.65 98.54 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 41.8 mm -64.0 -54.6 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.917 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.412 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 35.9 m -57.91 -33.24 68.55 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.745 0.307 . . . . 0.0 110.947 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.441 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -66.12 -42.92 88.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.674 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.488 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -71.14 -38.42 63.44 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 177.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.6 mm? -54.68 -59.96 4.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.018 -1.091 . . . . 0.0 109.447 178.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -33.55 71.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.027 0.441 . . . . 0.0 110.041 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.0 tp10 -61.27 -49.16 78.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.637 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.498 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -72.32 -49.09 37.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.845 -179.723 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 87.9 p -55.31 -43.57 75.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.939 0.4 . . . . 0.0 110.381 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.451 ' O ' ' CB ' ' A' ' 24' ' ' GLN . 87.6 t -74.36 -27.36 21.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.436 179.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.45 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 21.6 tp -68.9 -46.17 69.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.892 0.377 . . . . 0.0 110.305 179.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 9.3 mt -71.94 -35.14 69.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.433 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -82.71 -23.69 33.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.565 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.451 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -109.8 10.62 24.58 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.415 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.4 162.41 0.15 Allowed 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.2 t -110.3 134.98 50.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 119.645 1.111 . . . . 0.0 110.671 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 5.9 m-85 . . . . . 0 C--N 1.325 -0.492 0 CA-C-O 121.784 0.802 . . . . 0.0 110.937 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.524 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.2 mp . . . . . 0 C--O 1.23 0.063 0 CA-C-O 121.153 0.501 . . . . 0.0 112.127 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 13.7 p -77.14 153.63 5.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.816 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.85 173.06 12.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.113 0.482 . . . . 0.0 111.636 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -67.75 -39.16 84.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.165 -178.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -68.09 -37.36 81.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.136 0.493 . . . . 0.0 110.701 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -70.5 -37.61 74.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.753 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.415 ' HE3' ' CZ ' ' A' ' 85' ' ' TYR . 16.2 tpp -66.99 -42.4 85.12 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.561 178.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 99.1 t -56.85 -47.94 82.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.197 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -47.52 83.62 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.176 179.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 39.1 t -55.7 -43.6 74.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.752 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.6 t -64.96 -45.47 94.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.712 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.46 -49.07 77.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.479 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.451 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -58.1 -43.26 87.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.882 179.306 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.45 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 5.3 m0 -60.64 -41.37 94.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.076 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 22.9 ttm -62.48 -50.57 70.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.053 -179.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -69.21 -35.47 76.25 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.451 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.37 -39.37 83.09 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.627 179.158 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.449 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 10.7 m-85 -72.24 -45.74 58.93 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.311 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 10.2 mm -54.07 -55.18 15.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.374 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -70.06 -35.99 74.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.906 0.384 . . . . 0.0 111.169 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.496 ' CE1' ' NE2' ' A' ' 55' ' ' GLN . 2.2 t80 -63.07 -45.8 90.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.502 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.491 ' O ' ' CG2' ' A' ' 56' ' ' VAL . 36.0 m-85 -75.5 -33.1 60.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.424 ' HD3' ' CD2' ' A' ' 67' ' ' LEU . 12.3 ttp85 -58.56 -30.98 67.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.818 0.342 . . . . 0.0 110.578 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -95.35 -11.07 28.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.889 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.496 ' NE2' ' CE1' ' A' ' 51' ' ' TYR . 1.4 mt-30 -99.86 -5.67 28.07 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -178.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.491 ' CG2' ' O ' ' A' ' 52' ' ' TYR . 0.8 OUTLIER -73.15 154.01 7.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.711 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 18.7 p -120.87 171.16 8.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.476 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.56 -147.64 23.25 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.69 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.21 164.83 54.42 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.341 . . . . 0.0 110.862 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.62 -22.53 44.01 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.616 2.211 . . . . 0.0 112.76 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.29 -44.02 80.31 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.149 0.5 . . . . 0.0 110.778 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.6 -41.53 99.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.008 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.426 ' HA ' ' CG1' ' A' ' 56' ' ' VAL . 12.0 mtt180 -56.9 -51.17 70.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.009 179.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.05 -41.71 79.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.433 -179.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.48 -49.73 76.37 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.461 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.9 -33.37 66.85 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.055 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.424 ' CD2' ' HD3' ' A' ' 53' ' ' ARG . 5.4 mp -71.18 -33.27 69.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.607 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -72.17 -49.04 38.82 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -62.24 -30.72 71.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.195 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.39 -49.14 65.13 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.37 -48.32 74.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.783 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -72.11 -31.73 66.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.99 0.424 . . . . 0.0 110.071 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -61.64 -48.3 81.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.865 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 9.2 mt -67.7 -44.68 77.15 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.048 0.451 . . . . 0.0 110.617 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.3 m-20 -52.8 -42.06 64.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.462 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.4 t -80.65 -34.19 35.09 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.436 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.426 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 2.8 mt -73.5 -30.22 62.99 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.11 -29.89 60.7 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -179.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.545 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 11.7 m-20 -57.33 -50.2 89.53 Favored Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 111.558 0.207 . . . . 0.0 111.558 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.545 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 44.9 Cg_endo -69.8 -37.59 8.86 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.36 2.04 . . . . 0.0 112.649 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.464 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 1.5 t80 -64.76 -52.57 56.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.055 0.455 . . . . 0.0 110.678 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 28.5 mt -57.1 -30.02 64.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.576 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.81 -48.04 64.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.558 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.83 -41.78 78.45 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.949 0.404 . . . . 0.0 110.266 179.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.419 ' CD2' HD22 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -74.65 -33.2 62.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.294 179.391 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -42.45 98.87 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.64 -32.88 66.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.946 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.524 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 9.3 t80 -72.59 -28.78 63.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.049 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.419 HD22 ' CD2' ' A' ' 85' ' ' TYR . 2.2 mm? . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.018 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.455 -0.192 0 CA-C-O 120.768 0.318 . . . . 0.0 110.603 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -67.26 -45.35 76.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.437 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.478 ' CD2' ' HG3' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -62.72 -42.19 99.53 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.506 -0.554 . . . . 0.0 109.506 178.73 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 25.4 mt -62.35 -54.06 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.037 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.2 t -57.47 -33.24 67.76 Favored 'General case' 0 C--N 1.333 -0.144 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 -179.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.12 -42.63 75.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.782 0.325 . . . . 0.0 110.861 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.573 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -69.91 -40.06 74.58 Favored Glycine 0 C--O 1.225 -0.459 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 177.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -54.81 -59.17 5.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.592 -1.304 . . . . 0.0 109.448 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.425 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -60.23 -30.93 69.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.543 179.685 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.425 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 0.6 OUTLIER -67.69 -46.36 72.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.241 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.586 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -69.74 -49.36 53.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.718 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 74.6 p -55.4 -50.44 69.75 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.133 0.492 . . . . 0.0 110.151 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.456 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 47.2 t -62.56 -34.55 65.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.271 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.446 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 12.2 tp -62.56 -46.22 89.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.469 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 6.0 mt -63.91 -37.24 86.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.095 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.69 -17.44 44.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.824 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 5.2 mt-30 -106.99 -3.4 20.14 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -46.9 160.09 0.09 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 19.7 t -104.69 128.41 58.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 118.81 0.732 . . . . 0.0 111.73 -179.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.838 179.258 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.513 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 0.7 OUTLIER . . . . . 0 N--CA 1.461 0.098 0 CA-C-O 121.364 0.602 . . . . 0.0 111.94 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.404 ' CG2' ' CB ' ' A' ' 36' ' ' ASP . 11.4 p -77.1 157.54 5.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.04 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.0 p -79.51 171.01 15.74 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.263 0.554 . . . . 0.0 111.909 -178.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.4 ' O ' ' CG2' ' A' ' 38' ' ' VAL . 1.5 mt-10 -68.76 -34.45 75.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.112 -178.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -34.73 78.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.9 0.381 . . . . 0.0 110.716 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.404 ' CB ' ' CG2' ' A' ' 32' ' ' VAL . 0.3 OUTLIER -71.8 -42.15 67.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.115 179.454 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.44 ' HE3' ' CE2' ' A' ' 85' ' ' TYR . 12.5 tpp -65.15 -43.43 91.83 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.4 ' CG2' ' O ' ' A' ' 34' ' ' GLU . 93.9 t -55.89 -48.0 79.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.305 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -46.62 88.23 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.864 0.364 . . . . 0.0 110.364 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 23.7 t -56.75 -45.47 82.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.835 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.5 t -66.73 -44.98 89.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.789 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -51.16 71.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.415 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.422 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.2 OUTLIER -60.05 -43.48 95.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.156 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.446 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 7.9 m0 -60.78 -41.06 94.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.337 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.9 ttp -68.0 -43.98 77.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.327 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -70.87 -39.81 72.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.941 0.401 . . . . 0.0 110.014 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.445 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -59.38 -41.5 89.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.574 179.091 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.453 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 3.9 m-85 -65.01 -48.09 75.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.775 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -54.2 -55.0 16.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.082 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -68.97 -36.74 78.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.806 0.336 . . . . 0.0 111.085 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.445 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 7.0 t80 -63.07 -42.04 99.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.126 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.573 ' OH ' ' HA2' ' A' ' 14' ' ' GLY . 27.8 m-85 -75.47 -33.68 60.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.54 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.411 ' HA ' HD13 ' A' ' 67' ' ' LEU . 2.8 ttm-85 -58.37 -31.59 67.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.12 0.486 . . . . 0.0 110.581 179.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -101.03 -9.81 21.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.196 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.478 ' HG3' ' CD2' ' A' ' 10' ' ' LEU . 12.4 tp-100 -97.54 -3.29 40.04 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.652 ' HB ' ' CG ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -78.81 173.58 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.469 179.564 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.0 m -139.79 171.09 14.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.034 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 88.15 -150.4 22.07 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.171 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.9 162.95 65.67 Favored Pre-proline 0 C--N 1.334 -0.103 0 CA-C-O 120.829 0.347 . . . . 0.0 111.286 -179.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.26 -26.62 41.71 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.914 2.409 . . . . 0.0 113.319 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -70.82 -44.18 67.05 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.067 0.461 . . . . 0.0 110.891 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -67.38 -38.25 84.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.959 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.652 ' CG ' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -57.64 -51.3 70.07 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.39 0.614 . . . . 0.0 109.427 178.896 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -58.06 -41.64 83.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.649 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -61.59 -49.69 75.62 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.474 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.1 -33.66 67.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.22 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' A' ' 53' ' ' ARG . 5.5 mp -69.99 -36.55 75.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.32 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -72.89 -44.74 60.92 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.218 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -63.03 -38.59 91.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.351 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.447 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -63.39 -49.11 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.792 179.521 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -55.19 -44.85 75.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.523 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.26 -34.52 76.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.24 0.543 . . . . 0.0 109.846 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -60.88 -45.3 95.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.068 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.9 mt -67.61 -45.08 76.46 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.972 0.415 . . . . 0.0 110.366 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -39.8 63.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.011 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.3 t -80.55 -36.15 33.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.041 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.445 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 2.4 mt -71.24 -29.88 65.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.898 -179.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.84 -30.08 63.73 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.552 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.5 t30 -57.73 -50.09 90.06 Favored Pre-proline 0 CA--C 1.532 0.28 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 40.5 Cg_endo -67.69 -42.01 7.44 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.278 1.985 . . . . 0.0 112.828 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.438 ' HB2' ' CD1' ' A' ' 22' ' ' LEU . 1.8 t80 -63.76 -52.59 59.72 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.155 0.502 . . . . 0.0 110.036 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.403 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 24.1 mt -56.59 -29.28 61.9 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.429 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.433 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.03 -48.33 63.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.847 0.356 . . . . 0.0 110.519 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.2 mmtm -57.17 -40.78 77.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.551 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.44 ' CE2' ' HE3' ' A' ' 37' ' ' MET . 0.2 OUTLIER -77.61 -33.15 53.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.721 -179.544 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.433 ' HG2' ' HA ' ' A' ' 83' ' ' ALA . 1.0 OUTLIER -68.33 -40.52 81.57 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.016 179.409 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.59 -37.21 68.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.862 179.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.513 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 9.1 t80 -71.92 -29.22 64.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.14 178.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.422 178.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 120.678 0.275 . . . . 0.0 110.852 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -62.32 -44.12 97.23 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.443 . . . . 0.0 109.831 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.414 HD11 ' CD2' ' A' ' 52' ' ' TYR . 0.3 OUTLIER -60.63 -43.32 97.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.716 178.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 40.5 mm -62.04 -54.58 32.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.01 -32.91 22.77 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.668 0.271 . . . . 0.0 111.222 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.13 -42.06 69.7 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.596 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.554 ' N ' ' OH ' ' A' ' 52' ' ' TYR . . . -71.07 -28.42 70.39 Favored Glycine 0 C--O 1.231 -0.085 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 177.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -70.52 -61.17 1.87 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.511 -0.845 . . . . 0.0 109.092 178.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.427 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -57.21 -30.9 64.94 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.896 -179.954 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.427 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 1.5 mm-40 -68.24 -46.09 71.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.413 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.558 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -73.82 -47.38 39.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.351 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.52 -51.42 67.07 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.953 0.406 . . . . 0.0 110.484 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.482 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 58.0 t -66.41 -36.77 78.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.642 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.469 ' CD1' ' CZ2' ' A' ' 44' ' ' TRP . 0.8 OUTLIER -59.52 -46.18 89.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.76 0.314 . . . . 0.0 111.137 -179.818 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 15.0 mt -70.51 -34.92 72.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.987 0.422 . . . . 0.0 110.396 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -82.7 -18.43 40.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.154 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.482 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 2.1 mp0 -117.44 12.37 14.18 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -51.58 162.92 0.33 Allowed 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 177.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 24.2 t -112.57 136.41 48.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 119.854 1.206 . . . . 0.0 110.876 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.478 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.2 m-85 . . . . . 0 C--N 1.326 -0.442 0 CA-C-O 121.776 0.798 . . . . 0.0 110.545 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.466 HD23 ' CE2' ' A' ' 88' ' ' PHE . 7.6 mt . . . . . 0 N--CA 1.455 -0.18 0 CA-C-O 120.913 0.387 . . . . 0.0 111.058 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.485 ' CG2' ' HB3' ' A' ' 36' ' ' ASP . 14.9 p -74.83 143.91 12.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.829 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.7 p -79.97 172.79 13.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.957 0.408 . . . . 0.0 111.537 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.405 ' O ' ' CG2' ' A' ' 38' ' ' VAL . 0.0 OUTLIER -71.07 -29.66 65.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.423 -179.515 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.44 -38.27 81.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.223 0.535 . . . . 0.0 110.267 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.485 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 4.9 t70 -71.83 -36.92 70.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.501 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.402 ' HE3' ' CZ ' ' A' ' 85' ' ' TYR . 1.8 tpt -67.05 -45.71 76.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.482 178.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.405 ' CG2' ' O ' ' A' ' 34' ' ' GLU . 89.7 t -55.78 -46.54 79.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.302 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -46.3 88.94 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.847 0.356 . . . . 0.0 110.16 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.0 t -58.41 -44.05 87.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.696 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.9 t -65.48 -48.47 82.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.611 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.58 -46.52 77.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.464 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.605 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -64.53 -40.89 96.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.542 179.56 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.469 ' CZ2' ' CD1' ' A' ' 21' ' ' LEU . 5.8 m0 -60.83 -43.99 97.53 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.948 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.7 mtm -66.96 -48.91 67.1 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.781 -178.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -71.13 -28.1 64.04 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.605 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.76 -48.13 82.07 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.125 179.262 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -71.69 -38.48 70.59 Favored 'General case' 0 C--O 1.227 -0.09 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.114 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.414 ' CD1' ' HB2' ' A' ' 71' ' ' ARG . 10.8 mm -57.41 -55.34 21.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.799 0.333 . . . . 0.0 111.274 -179.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -67.33 -39.71 85.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.186 0.517 . . . . 0.0 110.386 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.485 ' CE1' ' HG3' ' A' ' 55' ' ' GLN . 0.5 OUTLIER -61.07 -38.2 85.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.485 179.599 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.554 ' OH ' ' N ' ' A' ' 14' ' ' GLY . 3.2 m-85 -76.1 -36.74 58.79 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -178.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.6 ttm180 -59.96 -26.53 66.07 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.419 -179.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 54' ' ' GLN . 6.9 tt0 -93.79 -13.51 27.26 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.485 ' HG3' ' CE1' ' A' ' 51' ' ' TYR . 18.7 mm-40 -103.09 1.94 34.03 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -178.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.506 ' HB ' ' HB3' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -85.85 168.96 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.288 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.1 p -142.58 171.34 14.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.837 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 87.39 -153.54 25.31 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.373 -0.918 . . . . 0.0 112.774 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.5 144.34 86.31 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-O 120.683 0.277 . . . . 0.0 110.891 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.445 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 19.1 Cg_endo -59.12 -24.6 74.47 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.79 2.327 . . . . 0.0 112.725 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.07 -38.32 75.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.938 0.399 . . . . 0.0 110.673 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -68.65 -47.0 67.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.284 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.506 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -63.51 -50.7 68.58 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.114 0.483 . . . . 0.0 110.066 179.743 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.39 -37.36 67.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.085 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.69 -50.14 59.19 Favored 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.467 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.57 -35.0 73.43 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.22 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.448 ' N ' HD22 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -69.44 -40.49 77.17 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.116 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -72.08 -41.62 67.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.079 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.489 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 7.9 mt-10 -66.78 -37.67 85.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.402 ' CD2' ' HA ' ' A' ' 67' ' ' LEU . 0.4 OUTLIER -67.04 -44.48 80.11 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.282 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.414 ' HB2' ' CD1' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -55.21 -49.01 73.05 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.828 179.509 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.489 ' HG2' ' HA ' ' A' ' 69' ' ' GLU . 8.4 pt20 -63.31 -31.83 73.09 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -63.83 -42.45 97.63 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.719 179.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.426 HD21 ' CD2' ' A' ' 18' ' ' PHE . 5.2 mt -68.02 -45.38 74.18 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 121.134 0.492 . . . . 0.0 110.062 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.76 -37.14 65.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.004 -179.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.0 t -80.86 -32.8 34.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.704 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.418 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 1.5 mt -75.07 -29.64 60.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.895 -179.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.17 -32.1 61.18 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.536 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 3.1 m120 -52.12 -50.2 80.22 Favored Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 49.0 Cg_endo -69.92 -34.98 13.0 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.353 2.036 . . . . 0.0 112.76 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.489 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 1.8 t80 -65.31 -53.67 40.49 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.1 mt -58.81 -28.08 65.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.449 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.467 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.71 -41.3 75.55 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.105 0.479 . . . . 0.0 110.376 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -42.52 92.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.587 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.402 ' CZ ' ' HE3' ' A' ' 37' ' ' MET . 0.4 OUTLIER -74.62 -37.92 62.7 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.927 -179.38 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.467 ' HG2' ' HA ' ' A' ' 83' ' ' ALA . 12.1 ptm180 -65.32 -37.31 86.73 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.5 -34.91 67.99 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.466 ' CE2' HD23 ' A' ' 31' ' ' LEU . 45.6 t80 -72.05 -28.29 63.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.765 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mm? . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.408 179.142 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.6 tttm . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 120.68 0.276 . . . . 0.0 110.988 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -67.78 -40.38 83.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.842 0.353 . . . . 0.0 110.347 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.5 tp -65.22 -44.28 88.82 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.8 mt -61.95 -54.5 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.493 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 23.1 t -55.61 -39.74 71.16 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.21 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.11 -40.11 80.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.23 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.473 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -70.66 -30.86 68.13 Favored Glycine 0 N--CA 1.451 -0.308 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.7 mm? -64.9 -61.33 2.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.102 -1.049 . . . . 0.0 110.608 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.3 mttm -62.17 -36.59 82.33 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -59.72 -50.67 72.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.97 178.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.496 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 1.0 OUTLIER -67.26 -50.54 60.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.101 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 t -57.81 -51.63 68.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.874 0.369 . . . . 0.0 111.089 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.9 t -64.75 -32.57 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.769 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.488 ' O ' ' N ' ' A' ' 25' ' ' GLN . 0.2 OUTLIER -70.36 -46.26 64.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.103 179.73 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.499 HD21 ' CD2' ' A' ' 81' ' ' PHE . 13.8 mt -62.1 -37.58 85.62 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.441 -179.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.63 -38.79 23.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.727 0.298 . . . . 0.0 111.603 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.732 ' O ' ' N ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -106.46 21.31 17.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.776 -179.208 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.488 ' N ' ' O ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -46.27 60.96 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.416 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.732 ' N ' ' O ' ' A' ' 24' ' ' GLN . 11.6 p 27.96 102.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 123.42 0.688 . . . . 0.0 112.517 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.52 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 14.2 m-30 . . . . . 0 C--N 1.329 -0.288 0 CA-C-O 121.515 0.674 . . . . 0.0 111.185 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.458 HD13 ' CE2' ' A' ' 88' ' ' PHE . 7.1 mt . . . . . 0 N--CA 1.455 -0.206 0 CA-C-O 121.013 0.435 . . . . 0.0 111.363 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.2 p -76.7 148.59 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.9 m -79.22 169.69 17.75 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.164 0.506 . . . . 0.0 111.535 -177.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.53 -36.61 81.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.03 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -36.53 84.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.152 0.501 . . . . 0.0 110.353 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.2 -37.62 63.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.337 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.441 ' HE3' ' CE1' ' A' ' 85' ' ' TYR . 0.2 OUTLIER -64.35 -47.23 80.14 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.716 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.2 t -57.61 -45.48 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.803 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.0 m -57.96 -47.9 81.55 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.822 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.415 HG13 ' CE3' ' A' ' 44' ' ' TRP . 40.8 t -57.65 -40.24 74.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.808 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 5.1 t -63.02 -48.05 89.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.528 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.484 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 0.3 OUTLIER -54.77 -45.58 74.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.735 179.726 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.537 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -72.15 -36.38 69.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.746 179.648 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.422 ' CH2' HD13 ' A' ' 21' ' ' LEU . 1.9 m0 -64.46 -45.33 87.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.321 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.484 ' SD ' ' HA ' ' A' ' 42' ' ' GLU . 1.9 ptm -71.5 -36.14 71.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.495 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -71.94 -40.81 68.47 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.537 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.5 -46.19 91.04 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.793 179.099 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.474 ' CD1' ' CZ ' ' A' ' 52' ' ' TYR . 3.4 m-85 -60.3 -47.67 85.04 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.644 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.4 mm -54.19 -55.34 14.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.357 -179.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.499 ' HA ' ' HG2' ' A' ' 53' ' ' ARG . 43.9 t30 -69.8 -33.39 72.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.029 0.442 . . . . 0.0 111.171 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.481 ' CZ ' ' NE2' ' A' ' 55' ' ' GLN . 17.0 t80 -68.19 -40.95 82.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.782 -179.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.474 ' CZ ' ' CD1' ' A' ' 48' ' ' TYR . 21.9 m-85 -75.68 -36.56 60.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.348 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.499 ' HG2' ' HA ' ' A' ' 50' ' ' ASN . 7.1 ptp85 -59.88 -24.64 64.43 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.498 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -92.52 -23.64 19.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.519 -179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.481 ' NE2' ' CZ ' ' A' ' 51' ' ' TYR . 29.0 mt-30 -93.71 34.21 1.22 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.036 0.446 . . . . 0.0 111.666 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.484 ' CG1' ' HG3' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -112.97 164.76 8.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.093 -179.665 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.6 m -138.45 171.74 13.92 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 81.56 -163.4 44.35 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 119.869 -1.158 . . . . 0.0 112.866 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -64.55 160.55 51.29 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-O 120.872 0.368 . . . . 0.0 111.36 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.62 -26.96 39.17 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.92 2.413 . . . . 0.0 112.984 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.62 -41.4 73.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.183 0.516 . . . . 0.0 111.287 -179.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -63.37 -46.66 85.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.029 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.484 ' HG3' ' CG1' ' A' ' 56' ' ' VAL . 2.3 mpt_? -56.09 -51.63 67.19 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.166 0.508 . . . . 0.0 110.26 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.409 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 0.1 OUTLIER -55.58 -41.6 73.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.256 -178.901 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -49.72 76.45 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.98 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.411 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.2 -36.93 71.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.946 -179.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mp -70.47 -33.26 71.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.8 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.409 ' CG ' ' O ' ' A' ' 64' ' ' ASP . 1.2 mt-30 -73.55 -48.54 32.17 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.941 0.401 . . . . 0.0 110.192 179.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.27 -33.19 74.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.423 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.502 ' O ' HD21 ' A' ' 74' ' ' LEU . 0.8 OUTLIER -69.39 -48.27 61.64 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.749 -0.38 . . . . 0.0 109.978 179.195 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -55.23 -40.83 71.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.926 0.393 . . . . 0.0 110.392 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.0 -46.41 43.85 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.408 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.492 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 34.2 mm-40 -60.61 -34.1 73.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.033 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.502 HD21 ' O ' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -68.86 -47.02 66.99 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.284 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -53.72 -37.23 63.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.877 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.543 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 1.0 OUTLIER -81.14 -50.74 9.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.048 179.546 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.492 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 3.9 mt -60.18 -39.54 86.85 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 -178.403 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.24 -46.95 81.55 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -177.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.487 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.5 OUTLIER -50.98 -50.48 74.6 Favored Pre-proline 0 CA--C 1.535 0.393 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.264 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.543 ' CD ' ' O ' ' A' ' 76' ' ' THR . 50.5 Cg_endo -69.86 -24.09 29.59 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 122.313 2.009 . . . . 0.0 112.946 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.499 ' CD2' HD21 ' A' ' 22' ' ' LEU . 1.3 t80 -67.84 -53.48 26.55 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.769 0.319 . . . . 0.0 110.89 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.12 -29.31 60.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.523 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.12 -47.51 57.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.39 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.2 mmmm -56.98 -38.99 73.8 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.496 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.441 ' CE1' ' HE3' ' A' ' 37' ' ' MET . 0.6 OUTLIER -73.85 -33.89 64.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.54 179.779 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -42.47 99.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.133 0.492 . . . . 0.0 109.757 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.88 -32.4 65.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.181 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.52 ' CE2' ' CD2' ' A' ' 27' ' ' PHE . 22.0 t80 -73.55 -28.72 62.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.956 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.8 mt . . . . . 0 C--N 1.329 -0.302 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.754 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.528 0.204 . . . . 0.0 111.048 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.26 -39.23 75.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.704 -0.226 . . . . 0.0 110.396 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.67 -44.77 85.24 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 179.062 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 42.4 mm -62.06 -54.45 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.05 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.7 t -61.42 -34.29 75.13 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 120.815 0.34 . . . . 0.0 110.276 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.11 -40.33 85.04 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.933 -179.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.481 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -68.96 -43.64 72.16 Favored Glycine 0 N--CA 1.454 -0.154 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 177.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -54.27 -58.62 6.69 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.081 -1.06 . . . . 0.0 109.613 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.44 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -60.84 -29.36 69.46 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.038 178.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.44 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 5.5 mt-10 -65.27 -48.9 71.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.977 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.494 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -65.49 -50.14 66.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.654 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -51.65 68.59 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.066 0.46 . . . . 0.0 110.787 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.404 ' CG2' ' O ' ' A' ' 16' ' ' LYS . 70.6 t -62.34 -28.26 44.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.477 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.452 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 1.5 tp -66.71 -46.45 75.51 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 2.1 mt -62.42 -38.1 88.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.776 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -24.88 34.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.31 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.483 ' C ' ' H ' ' A' ' 26' ' ' VAL . 3.1 tt0 -113.11 21.16 15.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.7 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.588 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -70.25 34.59 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.295 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.588 ' O ' ' O ' ' A' ' 25' ' ' GLN . 16.5 t 31.93 115.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 178.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 88' ' ' PHE . 2.7 m-85 . . . . . 0 CA--C 1.515 -0.369 0 CA-C-O 121.741 0.781 . . . . 0.0 110.682 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.437 ' HG ' ' N ' ' A' ' 32' ' ' VAL . 2.7 pt? . . . . . 0 CA--C 1.532 0.261 0 CA-C-O 120.618 0.246 . . . . 0.0 111.452 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.437 ' N ' ' HG ' ' A' ' 31' ' ' LEU . 13.7 p -74.49 138.92 20.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.411 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.8 p -80.31 175.37 10.71 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.016 0.436 . . . . 0.0 111.574 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.76 -38.89 87.51 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.117 -179.152 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.68 -36.07 82.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.287 0.565 . . . . 0.0 110.303 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -74.03 -34.81 64.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.427 178.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.452 ' HE2' ' CZ ' ' A' ' 81' ' ' PHE . 19.7 tpp -67.46 -47.31 70.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.629 178.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 49.0 t -56.64 -47.66 81.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.423 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -58.07 -46.06 86.07 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.42 HG11 ' CD2' ' A' ' 44' ' ' TRP . 48.2 t -59.13 -37.67 69.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.78 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.7 t -65.44 -49.13 80.17 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.781 0.324 . . . . 0.0 110.78 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.447 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 1.3 tt0 -55.37 -46.55 76.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.105 0.479 . . . . 0.0 110.777 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.603 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -71.74 -36.32 70.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.996 179.613 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.452 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 4.1 m0 -65.03 -45.82 83.87 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.523 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.533 ' HA ' HD13 ' A' ' 74' ' ' LEU . 1.6 ptm -71.41 -37.49 71.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.527 -179.399 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -71.34 -39.28 71.44 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.603 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.05 -45.88 92.97 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.058 179.194 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -61.64 -47.99 82.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.199 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -54.48 -55.28 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.217 -179.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 30.0 t30 -69.46 -37.3 77.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.008 0.432 . . . . 0.0 111.09 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.461 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 21.2 t80 -61.26 -43.8 98.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.864 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.524 ' O ' HG21 ' A' ' 56' ' ' VAL . 23.5 m-85 -75.51 -29.29 59.46 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.244 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.416 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . 10.4 ttm180 -57.55 -27.55 62.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.949 0.404 . . . . 0.0 110.172 178.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -101.81 -15.4 16.93 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -97.53 46.21 1.03 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.821 0.343 . . . . 0.0 111.63 -179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.524 HG21 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -125.3 164.62 24.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.299 -179.616 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 18.7 p -134.46 171.47 14.26 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 79.23 -149.95 33.03 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.016 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.98 156.12 92.46 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.822 0.344 . . . . 0.0 111.273 -179.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.45 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 42.8 Cg_endo -67.67 -25.94 39.79 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.73 2.287 . . . . 0.0 112.681 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.12 -41.68 93.16 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.894 0.378 . . . . 0.0 111.359 -179.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -61.1 -46.78 89.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.498 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.509 ' CD ' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.48 -50.81 68.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.207 0.527 . . . . 0.0 109.684 179.471 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -55.26 -41.4 72.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.693 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.439 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 14.5 ttmt -63.05 -49.91 72.7 Favored 'General case' 0 C--N 1.334 -0.104 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.656 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.23 -34.46 68.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.848 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.416 ' CD2' ' HB2' ' A' ' 53' ' ' ARG . 7.4 mp -71.81 -39.53 69.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.825 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.439 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 7.2 pt20 -73.2 -47.0 47.21 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.813 0.34 . . . . 0.0 110.403 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.461 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -62.32 -39.72 93.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.127 179.614 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.482 ' O ' HD21 ' A' ' 74' ' ' LEU . 7.0 mt -61.84 -48.89 78.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.197 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -55.45 -44.68 76.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.813 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.568 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -70.53 -38.26 74.21 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.142 0.496 . . . . 0.0 110.342 179.469 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.568 ' N ' ' HG3' ' A' ' 72' ' ' GLN . 1.7 tp10 -65.21 -32.78 74.62 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.24 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.6 ' N ' HD21 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -68.44 -45.91 71.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.515 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -53.7 -39.71 65.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.988 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.481 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 7.3 t -80.74 -50.58 9.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.85 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.9 mt -58.07 -35.14 70.94 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -179.116 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.44 -38.37 71.33 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.516 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 3.6 m120 -51.75 -50.28 78.51 Favored Pre-proline 0 C--N 1.328 -0.359 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 55.2 Cg_endo -70.08 -28.67 23.42 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.49 2.127 . . . . 0.0 113.18 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.455 ' CE2' HD21 ' A' ' 22' ' ' LEU . 2.3 t80 -65.51 -52.45 52.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.89 0.376 . . . . 0.0 111.4 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 55.0 mt -58.94 -28.64 66.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.841 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.25 -48.0 53.67 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.758 0.313 . . . . 0.0 110.434 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -56.93 -40.5 76.49 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.094 0.473 . . . . 0.0 110.115 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.44 ' CG ' ' HE1' ' A' ' 37' ' ' MET . 0.1 OUTLIER -70.95 -33.35 70.39 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.29 179.447 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 52.2 mmt-85 -61.52 -41.03 96.71 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.71 -31.11 64.76 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.352 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.495 ' CZ ' ' HB3' ' A' ' 27' ' ' PHE . 43.9 t80 -75.96 -28.75 58.03 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.213 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.1 mm? . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.564 179.177 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.152 0 CA-C-O 120.664 0.269 . . . . 0.0 111.038 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.4 -43.78 84.85 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.566 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.438 HD22 ' CD1' ' A' ' 52' ' ' TYR . 0.5 OUTLIER -60.25 -46.36 90.07 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.801 179.046 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.8 mt -60.66 -54.36 36.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.472 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 0.1 OUTLIER -53.92 -38.6 65.04 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 120.921 0.391 . . . . 0.0 110.435 179.57 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -58.49 -43.65 89.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.979 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.465 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -66.81 -28.05 73.6 Favored Glycine 0 N--CA 1.452 -0.239 0 N-CA-C 110.076 -1.21 . . . . 0.0 110.076 176.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.451 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.1 OUTLIER -68.58 -61.48 1.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.475 -0.862 . . . . 0.0 110.617 179.397 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 12' ' ' SER . 2.6 mmtp -56.78 -35.38 68.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.143 0.497 . . . . 0.0 110.11 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.1 tt0 -59.87 -50.72 72.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.663 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.444 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -73.59 -44.74 56.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.472 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.11 -51.67 68.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.89 0.376 . . . . 0.0 110.774 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 47.6 t -66.91 -33.49 63.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.676 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.488 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 1.1 tp -68.44 -45.69 71.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.862 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.538 HD21 ' CD2' ' A' ' 81' ' ' PHE . 2.8 mt -63.15 -42.85 99.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.83 0.347 . . . . 0.0 110.814 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -82.8 -23.78 33.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.82 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.512 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -117.58 21.53 12.94 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -178.727 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.476 ' O ' ' C ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -67.05 42.23 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.321 0.105 . . . . 0.0 111.247 179.891 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.512 ' H ' ' C ' ' A' ' 24' ' ' GLN . 16.8 t -6.79 124.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.112 0.965 . . . . 0.0 113.558 -179.691 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.427 ' CE1' ' OE1' ' A' ' 25' ' ' GLN . 17.9 m-85 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.722 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.0 mt . . . . . 0 C--O 1.231 0.1 0 CA-C-O 121.091 0.472 . . . . 0.0 111.416 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 12.8 p -88.31 153.4 3.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.178 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.9 p -79.67 175.53 10.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.102 0.477 . . . . 0.0 111.806 -178.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -70.3 -41.14 73.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.852 -178.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.34 -36.55 84.49 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.19 0.519 . . . . 0.0 110.496 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -73.49 -35.82 65.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.612 178.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 2.7 tpt -66.87 -43.12 84.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.503 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 50.5 t -59.48 -45.68 93.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.264 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -47.14 84.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.114 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 22.9 t -58.6 -43.45 87.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.563 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 26.1 t -59.2 -48.83 85.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.589 179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.55 -42.03 77.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.582 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.45 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -58.18 -46.44 85.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.149 179.368 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.488 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 28.8 m0 -60.69 -40.63 92.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.969 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 31.5 ttm -64.2 -50.89 66.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.769 -0.65 . . . . 0.0 112.379 -178.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -70.24 -29.31 66.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.002 0.43 . . . . 0.0 110.18 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.45 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.81 -42.33 97.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.122 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.434 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 27.0 m-85 -73.06 -41.74 63.83 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.527 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.9 mm -55.7 -55.4 17.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.499 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -69.48 -38.37 77.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.965 0.412 . . . . 0.0 110.968 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.413 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.7 t80 -59.89 -46.2 90.09 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.212 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.465 ' OH ' ' HA2' ' A' ' 14' ' ' GLY . 23.0 m-85 -75.84 -28.93 58.42 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.436 ' HG3' HD23 ' A' ' 67' ' ' LEU . 11.4 ttm180 -65.22 -28.66 69.52 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.746 -0.381 . . . . 0.0 110.757 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -91.49 -21.78 20.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.092 -178.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -94.17 46.1 1.15 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.42 ' CG1' ' HG3' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -132.19 -176.13 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.237 0.541 . . . . 0.0 112.0 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.985 ' O ' ' N ' ' A' ' 59' ' ' GLU . 1.5 p -128.49 163.67 24.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.399 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -32.81 50.4 0.0 OUTLIER Glycine 0 N--CA 1.473 1.134 0 N-CA-C 115.003 0.761 . . . . 0.0 115.003 -178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.985 ' N ' ' O ' ' A' ' 57' ' ' THR . 2.2 mm-40 -110.57 65.11 0.44 Allowed Pre-proline 0 N--CA 1.432 -1.346 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 176.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -51.42 -43.37 50.15 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 121.173 1.248 . . . . 0.0 111.015 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -71.02 -36.3 72.36 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.621 178.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.612 ' HB3' ' HB3' ' A' ' 59' ' ' GLU . 0.1 OUTLIER -79.63 -35.05 40.03 Favored 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 119.781 -0.768 . . . . 0.0 111.996 -179.68 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.422 ' O ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -65.84 -52.5 49.92 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 179.758 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.29 -41.55 84.65 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.976 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.44 -45.79 71.58 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 119.946 -0.702 . . . . 0.0 110.077 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.95 -39.72 75.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.116 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.436 HD23 ' HG3' ' A' ' 53' ' ' ARG . 7.2 mp -69.82 -35.33 74.7 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.024 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.421 ' O ' ' HG2' ' A' ' 71' ' ' ARG . 3.9 mm-40 -70.42 -46.97 62.89 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.192 0.52 . . . . 0.0 109.728 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.1 -27.24 67.91 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.178 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.36 -50.17 23.38 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.421 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 13.9 ptm180 -57.63 -41.56 81.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.304 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -31.36 61.09 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -61.59 -46.77 88.43 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.256 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.2 mt -67.92 -42.83 80.47 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-O 121.051 0.453 . . . . 0.0 110.182 178.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -52.47 -42.08 63.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.177 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.1 t -81.13 -29.69 34.71 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.815 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.44 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 5.9 mt -79.37 -37.86 36.34 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.71 -29.89 59.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.626 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.55 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -51.07 -50.3 76.06 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.885 -178.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.55 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 45.7 Cg_endo -69.4 -31.02 22.98 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.061 1.841 . . . . 0.0 112.39 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.538 ' CD2' HD21 ' A' ' 22' ' ' LEU . 1.1 t80 -69.85 -54.59 12.84 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.7 mt -55.77 -34.45 65.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.146 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.609 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . . . -62.43 -48.28 80.37 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.299 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -44.7 88.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.966 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -71.32 -41.01 70.4 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.609 ' HG2' ' HA ' ' A' ' 83' ' ' ALA . 0.4 OUTLIER -62.75 -36.73 83.97 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.175 -179.71 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.438 ' N ' ' HG3' ' A' ' 86' ' ' ARG . 0.5 OUTLIER -72.82 -36.4 67.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.197 0.522 . . . . 0.0 109.93 178.645 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -70.5 -32.86 70.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.687 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.2 mm? . . . . . 0 C--N 1.331 -0.235 0 CA-C-O 121.42 0.629 . . . . 0.0 109.622 178.502 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.44 ' O ' HG23 ' A' ' 11' ' ' ILE . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 120.737 0.303 . . . . 0.0 110.894 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -71.17 -41.13 70.75 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.4 tp -62.13 -46.06 90.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.975 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.496 ' CG2' ' N ' ' A' ' 12' ' ' SER . 0.4 OUTLIER -62.99 -53.86 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 C-N-CA 120.506 -0.478 . . . . 0.0 109.743 179.174 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.496 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -55.83 -33.06 64.13 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 120.91 0.386 . . . . 0.0 110.433 179.503 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.01 -41.6 90.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.583 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.465 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -69.56 -42.44 72.53 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 177.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.9 mt -54.52 -59.52 4.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 113.844 -1.178 . . . . 0.0 109.32 178.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.419 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -59.59 -29.42 67.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.739 179.687 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.419 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 7.3 tt0 -68.47 -45.84 71.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.191 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.528 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.3 OUTLIER -74.3 -48.45 28.31 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.065 -179.825 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 77.7 p -55.69 -49.75 72.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.031 0.444 . . . . 0.0 110.353 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.454 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 91.3 t -68.24 -33.12 58.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.521 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.418 HD23 ' CZ2' ' A' ' 44' ' ' TRP . 4.5 tp -63.77 -45.9 87.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.798 0.333 . . . . 0.0 110.725 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 4.8 mt -68.5 -36.63 79.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.952 0.406 . . . . 0.0 110.196 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -82.53 -17.54 44.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.505 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.454 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 11.4 mt-30 -111.11 14.25 21.86 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -49.47 162.73 0.14 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.52 131.73 58.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 119.491 1.041 . . . . 0.0 111.372 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 . . . . . 0 C--N 1.325 -0.474 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.939 179.433 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.522 -0.122 0 CA-C-O 121.07 0.462 . . . . 0.0 111.024 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.2 p -70.41 143.67 14.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.195 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.96 172.14 14.17 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.278 0.561 . . . . 0.0 112.121 -178.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -62.34 -43.78 98.02 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.328 -178.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -34.83 78.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.127 0.489 . . . . 0.0 110.929 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -73.99 -36.95 64.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.656 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.419 ' HG2' ' CD2' ' A' ' 85' ' ' TYR . 3.5 tpt -66.81 -47.95 70.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.639 178.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.3 t -55.73 -45.79 79.44 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.236 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -58.12 -46.03 86.27 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.413 ' HA ' ' OD2' ' A' ' 43' ' ' ASP . 46.0 t -57.75 -41.53 79.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.996 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.6 t -70.43 -46.96 68.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.23 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.05 -47.5 80.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.031 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.586 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 3.3 p30 -68.96 -35.05 76.31 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.061 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.418 ' CZ2' HD23 ' A' ' 21' ' ' LEU . 3.9 m0 -60.72 -43.63 97.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.85 178.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.8 mtm -68.5 -45.71 71.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.661 -178.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.451 ' ND2' ' HA ' ' A' ' 43' ' ' ASP . 0.4 OUTLIER -71.58 -32.0 67.57 Favored 'General case' 0 CA--C 1.521 -0.154 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.914 179.707 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.586 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.96 -47.01 86.75 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.697 179.072 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.492 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 12.3 m-85 -65.88 -42.68 90.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.934 0.397 . . . . 0.0 110.582 179.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.4 mm -55.63 -55.44 17.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.364 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -72.33 -38.64 68.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.123 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.471 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 13.4 t80 -60.71 -46.38 90.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.998 -179.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.544 ' HA ' ' OE1' ' A' ' 55' ' ' GLN . 30.2 m-85 -75.6 -29.75 59.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.938 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.441 ' HA ' HD12 ' A' ' 67' ' ' LEU . 33.2 ttm180 -61.85 -27.95 69.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.826 0.346 . . . . 0.0 110.575 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -97.08 -16.01 20.71 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -178.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.544 ' OE1' ' HA ' ' A' ' 52' ' ' TYR . 6.0 pt20 -107.01 43.21 1.19 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -117.15 156.94 18.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.631 0.253 . . . . 0.0 110.364 178.538 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.4 p -131.08 171.46 13.22 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 85.24 -156.78 31.16 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.776 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -68.6 159.96 79.08 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.742 0.306 . . . . 0.0 111.034 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.4 -27.97 39.56 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.641 2.227 . . . . 0.0 112.333 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -42.25 99.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.848 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.45 -46.59 85.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.559 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.464 ' HD3' ' HB ' ' A' ' 56' ' ' VAL . 7.9 mtt180 -53.74 -51.84 62.06 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.8 -42.15 75.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.563 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.404 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 2.2 tttt -63.75 -31.94 73.28 Favored 'General case' 0 CA--C 1.522 -0.111 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.732 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.69 -40.74 65.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.463 HD11 ' O ' ' A' ' 63' ' ' ARG . 6.8 mp -71.71 -33.46 68.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.597 -179.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 5.5 pt20 -74.05 -48.97 26.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.868 0.366 . . . . 0.0 110.155 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -63.11 -33.19 74.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.476 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.416 HD12 ' CD2' ' A' ' 52' ' ' TYR . 2.7 mt -67.69 -49.33 63.29 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 67.9 ttp85 -55.41 -45.75 76.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.607 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -71.98 -32.78 67.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.202 0.525 . . . . 0.0 109.851 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -63.49 -46.92 83.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.068 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.44 HD21 ' CE2' ' A' ' 18' ' ' PHE . 0.9 OUTLIER -67.9 -45.25 74.96 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 121.085 0.469 . . . . 0.0 110.396 178.699 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.09 -39.39 63.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.915 -179.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.1 p -80.69 -33.74 35.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.982 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.435 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 4.9 mt -73.14 -31.21 64.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.968 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.34 -30.26 61.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -179.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.543 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.6 m-80 -56.4 -50.34 88.24 Favored Pre-proline 0 C--N 1.328 -0.327 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -179.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 54.1 Cg_endo -69.67 -38.96 7.26 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.415 2.077 . . . . 0.0 112.667 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.51 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 6.1 t80 -62.91 -53.47 53.55 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.011 0.434 . . . . 0.0 110.5 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.1 mt -56.02 -30.57 62.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.749 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.498 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.0 -43.24 75.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.957 0.408 . . . . 0.0 110.528 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.3 mtmt -62.2 -43.3 99.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.818 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.419 ' CD2' ' HG2' ' A' ' 37' ' ' MET . 0.2 OUTLIER -77.28 -33.55 55.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.875 -179.388 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.498 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 8.4 ptm180 -67.1 -38.5 85.76 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.75 -36.26 67.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.657 178.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -71.55 -29.09 64.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.392 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.653 178.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.706 0.288 . . . . 0.0 110.512 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -65.89 -45.04 83.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.146 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 tp -59.9 -45.1 93.6 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 37.3 mm -60.05 -54.22 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.2 p -51.09 -32.98 24.13 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.817 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.03 -44.9 71.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.407 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.474 ' HA3' ' HG2' ' A' ' 17' ' ' GLU . . . -66.55 -28.14 73.57 Favored Glycine 0 N--CA 1.452 -0.296 0 N-CA-C 110.694 -0.962 . . . . 0.0 110.694 177.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 mp -75.45 -60.68 2.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.388 -0.906 . . . . 0.0 110.964 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.7 ttpp -60.39 -36.81 78.95 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.712 0.291 . . . . 0.0 110.84 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.474 ' HG2' ' HA3' ' A' ' 14' ' ' GLY . 8.1 pt-20 -67.37 -47.73 69.52 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.486 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.43 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 1.3 t80 -65.98 -44.39 85.01 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.205 179.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 71.2 m -56.84 -51.59 68.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.591 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.7 t -63.42 -29.36 47.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.412 179.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.431 ' CD1' ' CH2' ' A' ' 44' ' ' TRP . 19.1 tp -70.26 -45.88 65.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.471 179.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.439 HD21 ' CD2' ' A' ' 81' ' ' PHE . 6.3 mt -65.95 -40.92 91.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.168 -179.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -82.52 -39.13 22.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.614 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.02 21.15 16.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.706 -179.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.556 ' O ' ' CB ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -36.06 -53.66 0.78 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.144 -179.855 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.556 ' CB ' ' O ' ' A' ' 25' ' ' GLN . 47.2 t 121.48 111.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.149 0.979 . . . . 0.0 110.405 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 8.2 m-30 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.54 179.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.458 -0.071 0 CA-C-O 121.46 0.648 . . . . 0.0 112.256 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.404 ' CG2' ' HB3' ' A' ' 36' ' ' ASP . 14.1 p -80.45 157.82 4.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.984 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.9 m -79.18 171.36 15.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.243 0.544 . . . . 0.0 111.687 -178.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.28 -37.5 77.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.943 -178.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.65 -32.96 74.6 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.955 0.407 . . . . 0.0 111.031 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.404 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -74.33 -39.51 62.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.985 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.432 ' HG2' ' CD2' ' A' ' 85' ' ' TYR . 4.4 tpp -67.53 -45.17 76.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.881 179.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 56.3 t -59.23 -44.35 91.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.611 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -61.05 -46.68 89.72 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.378 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 43.2 t -58.8 -43.77 88.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.874 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 13.8 t -65.29 -46.25 91.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.848 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.69 -45.22 85.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.565 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.43 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -66.46 -42.31 87.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.49 179.495 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.431 ' CH2' ' CD1' ' A' ' 21' ' ' LEU . 9.5 m0 -60.87 -38.97 87.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.895 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 42.5 mtm -71.06 -42.24 69.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.246 -178.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -72.01 -40.52 68.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.852 0.358 . . . . 0.0 110.302 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.452 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -63.65 -39.37 94.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.019 179.382 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.43 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 1.6 m-85 -66.47 -48.46 69.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.063 -179.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.47 ' O ' ' CG ' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -57.42 -55.75 19.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.758 -179.532 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -63.14 -38.68 92.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.932 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.452 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 4.3 t80 -62.85 -45.93 90.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.621 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.528 ' CD1' ' NE2' ' A' ' 55' ' ' GLN . 32.7 m-85 -70.51 -30.39 67.14 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -178.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.521 ' HA ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -61.23 -19.39 61.6 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.019 179.633 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -102.42 -16.69 16.11 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.142 0.794 . . . . 0.0 113.142 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.528 ' NE2' ' CD1' ' A' ' 52' ' ' TYR . 0.7 OUTLIER -100.18 46.16 0.96 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 120.617 -0.433 . . . . 0.0 112.081 -179.307 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.515 ' HB ' ' HD3' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -120.08 159.72 21.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.961 0.41 . . . . 0.0 111.106 179.396 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.6 p -134.71 171.74 13.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 82.56 -161.71 40.88 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.273 -0.965 . . . . 0.0 112.95 179.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.77 162.72 26.32 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-O 120.816 0.341 . . . . 0.0 111.007 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.56 -32.02 32.16 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.567 2.178 . . . . 0.0 112.557 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.54 -42.53 96.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.008 0.432 . . . . 0.0 111.047 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -62.35 -46.76 87.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.528 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.528 ' O ' HD11 ' A' ' 67' ' ' LEU . 5.5 mtt180 -53.56 -52.13 60.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.286 0.565 . . . . 0.0 109.492 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -55.42 -42.23 73.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.45 -178.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 1.0 OUTLIER -61.76 -34.65 76.23 Favored 'General case' 0 CA--C 1.521 -0.137 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.506 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.59 66.83 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.086 179.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.528 HD11 ' O ' ' A' ' 63' ' ' ARG . 1.1 mp -66.08 -38.69 88.9 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.709 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.426 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 0.6 OUTLIER -70.01 -44.66 68.85 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.231 179.843 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.3 -34.28 76.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.405 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.425 HD13 ' CD2' ' A' ' 52' ' ' TYR . 0.5 OUTLIER -65.1 -49.65 69.16 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.14 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.3 ttm-85 -55.28 -48.7 73.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.861 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.439 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.1 OUTLIER -68.68 -31.21 70.16 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.187 0.518 . . . . 0.0 110.092 179.196 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 0.0 OUTLIER -62.17 -45.7 92.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.948 179.761 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.61 -44.39 78.18 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.147 0.499 . . . . 0.0 110.29 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -52.25 -43.43 64.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.142 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.47 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 66.6 m -79.95 -50.48 10.36 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.708 0.289 . . . . 0.0 111.246 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 4.4 mt -56.69 -37.94 71.57 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.43 -37.05 77.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -178.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.512 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.1 t30 -51.65 -50.54 76.66 Favored Pre-proline 0 CA--C 1.534 0.335 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 53.2 Cg_endo -69.94 -34.68 13.51 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.583 2.189 . . . . 0.0 113.338 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.439 ' CD2' HD21 ' A' ' 22' ' ' LEU . 1.4 t80 -64.41 -53.79 42.99 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.698 0.285 . . . . 0.0 110.76 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.1 mt -53.94 -29.93 44.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.65 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.09 -44.7 65.16 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.257 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.0 -43.05 81.35 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.586 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.432 ' CD2' ' HG2' ' A' ' 37' ' ' MET . 0.3 OUTLIER -73.44 -33.33 64.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.942 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -46.09 83.81 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.93 -32.23 70.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.932 178.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.511 ' CE2' ' CD2' ' A' ' 27' ' ' PHE . 5.6 t80 -72.1 -28.76 63.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.448 179.112 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.022 179.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.547 ' O ' HG23 ' A' ' 11' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.892 0.377 . . . . 0.0 110.954 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -72.76 -44.35 61.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.863 0.363 . . . . 0.0 110.213 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.462 HD22 ' CD2' ' A' ' 52' ' ' TYR . 5.1 tp -59.86 -49.29 78.29 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.361 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.547 HG23 ' O ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -57.25 -49.73 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.042 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -55.24 -33.02 62.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.757 179.324 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.92 -44.13 77.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.378 -179.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.477 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -69.59 -40.18 77.89 Favored Glycine 0 C--O 1.229 -0.175 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 177.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.3 mt -54.48 -59.21 4.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 113.761 -1.22 . . . . 0.0 109.557 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.0 pttm -59.57 -31.02 69.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.418 179.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.2 -46.9 75.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.129 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.57 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -64.11 -49.17 73.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.095 -179.817 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 98.0 p -55.17 -51.41 66.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.875 0.369 . . . . 0.0 111.065 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.449 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 38.1 t -61.42 -40.58 86.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.155 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.47 -46.11 84.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.081 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 33.0 mt -62.99 -36.54 83.86 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.301 -179.289 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -82.65 -22.42 34.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.602 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.495 ' C ' ' H ' ' A' ' 26' ' ' VAL . 1.7 mt-30 -117.4 21.86 12.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.668 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.522 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -66.01 37.08 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -179.162 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.522 ' O ' ' O ' ' A' ' 25' ' ' GLN . 18.4 t 31.6 112.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 178.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.466 ' HB3' ' CZ ' ' A' ' 88' ' ' PHE . 34.0 m-85 . . . . . 0 CA--C 1.519 -0.218 0 CA-C-O 121.357 0.599 . . . . 0.0 110.627 178.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.517 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.9 mp . . . . . 0 CA--C 1.521 -0.171 0 CA-C-O 121.131 0.491 . . . . 0.0 111.664 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.407 ' CG2' ' CB ' ' A' ' 36' ' ' ASP . 13.8 p -76.45 148.9 6.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.33 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.4 m -79.77 172.41 13.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.144 0.497 . . . . 0.0 111.503 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.56 -38.95 84.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.732 -179.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -66.74 -37.31 84.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.164 0.507 . . . . 0.0 110.344 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.407 ' CB ' ' CG2' ' A' ' 32' ' ' VAL . 1.1 m-20 -68.55 -39.32 81.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.612 178.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -41.66 89.89 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.478 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 96.7 t -55.85 -47.94 78.98 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.915 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -46.92 85.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.988 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 39.1 t -55.63 -52.03 52.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.76 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 38.9 t -61.03 -42.91 94.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.446 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.41 -50.24 74.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.451 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.466 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -59.18 -46.3 88.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.439 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 16.0 m0 -60.7 -40.45 92.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.583 179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.2 ttp -67.74 -42.9 81.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.8 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -73.51 -34.75 65.41 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.466 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.89 -45.22 90.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.763 179.157 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -65.45 -46.5 79.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.273 -179.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.439 ' CD1' ' HB2' ' A' ' 71' ' ' ARG . 0.6 OUTLIER -58.53 -55.5 22.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.66 -179.772 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.428 ' HA ' ' HG3' ' A' ' 53' ' ' ARG . 18.1 t30 -62.47 -42.21 99.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.781 179.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.505 ' CD1' ' OE1' ' A' ' 55' ' ' GLN . 13.8 t80 -60.13 -48.89 79.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.771 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.544 ' HA ' ' CD ' ' A' ' 55' ' ' GLN . 5.3 m-85 -64.5 -33.66 76.41 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -179.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.433 ' CG ' ' O ' ' A' ' 49' ' ' ILE . 5.8 mtm105 -56.37 -26.35 52.62 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.375 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -99.26 -16.15 18.61 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.544 ' CD ' ' HA ' ' A' ' 52' ' ' TYR . 1.9 pt20 -103.4 38.9 1.68 Allowed 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.658 ' HB ' ' HD2' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -110.56 159.13 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 178.465 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.0 m -129.58 171.5 12.53 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 87.36 -155.9 27.61 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.893 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.2 160.33 83.01 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.706 0.289 . . . . 0.0 110.829 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.472 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 27.2 Cg_endo -62.23 -32.64 82.41 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.68 2.253 . . . . 0.0 112.718 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -62.47 -43.11 99.61 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.213 0.53 . . . . 0.0 110.871 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -60.68 -40.9 93.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.016 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.658 ' HD2' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -58.08 -50.95 71.69 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.686 179.271 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.37 -41.67 72.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.391 -179.039 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.7 tttm -66.52 -49.86 65.12 Favored 'General case' 0 CA--C 1.522 -0.112 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.278 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.42 -37.29 72.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.69 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.56 HD11 ' N ' ' A' ' 67' ' ' LEU . 8.1 mp -66.67 -41.81 87.57 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.093 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.414 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 1.7 pp0? -67.82 -41.7 82.67 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.85 0.357 . . . . 0.0 110.318 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.414 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 0.5 OUTLIER -62.25 -38.61 89.92 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.248 179.691 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.446 ' HG ' ' CG ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -61.4 -48.7 80.03 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.011 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.439 ' HB2' ' CD1' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -55.27 -48.97 73.25 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.088 -179.66 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.6 -32.67 72.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.075 0.464 . . . . 0.0 110.223 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -60.59 -45.59 93.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.953 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 10.1 mt -67.76 -44.44 77.49 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.022 0.439 . . . . 0.0 110.521 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -52.64 -42.78 64.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.227 -179.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.1 m -78.29 -32.74 49.59 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.023 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.411 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 2.7 mt -72.72 -30.67 64.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.844 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.79 -28.87 60.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.553 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.7 t30 -58.49 -50.17 89.5 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.822 0.304 . . . . 0.0 111.822 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.553 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 46.7 Cg_endo -69.03 -41.01 5.65 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.462 2.108 . . . . 0.0 113.014 -179.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.494 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 5.1 t80 -58.21 -50.18 74.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.033 0.444 . . . . 0.0 110.869 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.1 mt -54.53 -37.24 65.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.327 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.24 -44.27 79.86 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.771 0.319 . . . . 0.0 110.615 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.83 -40.88 76.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.067 0.46 . . . . 0.0 110.34 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -76.15 -33.36 59.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.632 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.41 ' HG2' ' N ' ' A' ' 87' ' ' ASP . 0.0 OUTLIER -61.12 -45.92 92.73 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.054 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.41 ' N ' ' HG2' ' A' ' 86' ' ' ARG . 0.4 OUTLIER -71.05 -33.57 70.4 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.071 178.939 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.517 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 16.8 t80 -69.59 -28.81 66.28 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.263 178.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.208 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 178.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.439 ' O ' HG23 ' A' ' 11' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.148 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.406 ' N ' ' HG3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -74.79 -46.17 38.71 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.495 -179.79 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.57 -49.06 79.22 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.487 ' CG2' ' N ' ' A' ' 12' ' ' SER . 1.2 tt -56.77 -51.64 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.22 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.487 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 3.5 m -51.12 -33.44 26.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.361 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.54 -47.3 55.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.867 0.365 . . . . 0.0 111.085 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -66.93 -27.99 73.62 Favored Glycine 0 C--O 1.229 -0.162 0 N-CA-C 110.169 -1.173 . . . . 0.0 110.169 177.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -71.32 -61.25 1.84 Allowed 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.328 -0.936 . . . . 0.0 110.159 179.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -57.74 -36.78 72.54 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.37 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -63.95 -49.61 71.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.677 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.533 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -67.52 -42.53 82.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.956 -179.476 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.1 m -55.48 -50.13 70.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.001 0.429 . . . . 0.0 110.942 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.43 ' O ' ' CB ' ' A' ' 24' ' ' GLN . 24.7 t -66.47 -39.33 83.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.637 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.461 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 2.8 tp -64.27 -46.13 85.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.743 0.306 . . . . 0.0 111.462 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -65.87 -42.35 90.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.05 -179.403 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -82.6 -17.96 42.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.911 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.43 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 13.3 tt0 -117.66 21.61 12.86 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -179.127 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.55 ' O ' ' CB ' ' A' ' 26' ' ' VAL . 0.6 OUTLIER -49.6 -67.35 0.27 Allowed 'General case' 0 C--N 1.331 -0.23 0 O-C-N 122.388 -0.195 . . . . 0.0 111.151 179.757 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.55 ' CB ' ' O ' ' A' ' 25' ' ' GLN . 50.2 t 120.57 119.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.161 0.984 . . . . 0.0 110.667 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 . . . . . 0 C--N 1.331 -0.212 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.977 179.927 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.432 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.0 OUTLIER . . . . . 0 CA--C 1.523 -0.073 0 CA-C-O 120.985 0.421 . . . . 0.0 111.205 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 5.5 p -80.72 157.25 4.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.634 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.67 171.19 15.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.134 0.492 . . . . 0.0 111.5 -178.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -32.0 68.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.28 -179.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.08 -35.98 82.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.013 0.435 . . . . 0.0 110.196 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -70.7 -42.37 70.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.855 179.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.1 -44.79 94.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.815 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.3 t -57.11 -47.27 84.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.699 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.402 ' CG2' ' N ' ' A' ' 40' ' ' VAL . 0.5 OUTLIER -63.52 -47.36 81.97 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.48 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.402 ' N ' ' CG2' ' A' ' 39' ' ' THR . 41.7 t -59.33 -42.94 88.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.725 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 54.8 t -66.3 -48.6 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.476 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.08 -44.67 83.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.349 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -59.07 -48.42 81.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.435 179.506 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.461 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 32.5 m0 -60.84 -41.12 95.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.462 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 22.5 ttm -67.77 -43.0 80.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.64 -179.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -73.22 -33.26 65.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.987 0.422 . . . . 0.0 109.906 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.472 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -62.54 -41.89 99.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.856 179.151 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -70.65 -43.02 70.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.707 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.422 ' CD1' ' HB3' ' A' ' 71' ' ' ARG . 2.2 mm -56.23 -55.1 20.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.966 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.0 m-80 -68.36 -40.14 81.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.01 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.414 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.5 t80 -59.06 -53.66 55.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.466 ' CD2' ' CD2' ' A' ' 70' ' ' LEU . 23.5 m-85 -68.8 -28.52 66.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.405 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.403 ' HA ' ' CD2' ' A' ' 67' ' ' LEU . 42.2 ttm-85 -59.72 -28.96 67.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.07 0.462 . . . . 0.0 110.16 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.3 -9.42 19.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.792 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -95.64 11.96 31.44 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -178.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.627 ' HB ' ' CG ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -94.89 177.05 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.236 0.541 . . . . 0.0 111.615 -179.813 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 35.0 p -149.53 171.74 16.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.299 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 80.33 -173.98 54.93 Favored Glycine 0 CA--C 1.519 0.296 0 C-N-CA 120.241 -0.98 . . . . 0.0 114.015 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.7 152.26 7.04 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.274 -0.463 . . . . 0.0 111.418 -179.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.424 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 14.1 Cg_endo -56.82 -33.35 94.34 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.121 2.547 . . . . 0.0 113.3 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.33 -43.17 98.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.134 0.492 . . . . 0.0 110.912 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.53 -46.77 86.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.642 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.627 ' CG ' ' HB ' ' A' ' 56' ' ' VAL . 0.4 OUTLIER -54.52 -51.88 63.75 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 121.036 0.445 . . . . 0.0 110.045 179.937 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.01 -42.07 75.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.058 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.476 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 25.1 tttm -61.96 -35.07 77.36 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 120.946 0.403 . . . . 0.0 110.989 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.454 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -70.68 -40.88 72.67 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.611 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.445 HD11 ' O ' ' A' ' 63' ' ' ARG . 6.7 mp -70.24 -33.01 71.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.634 -179.616 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.518 ' HA ' ' HG2' ' A' ' 71' ' ' ARG . 12.1 pt20 -74.71 -48.3 26.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.836 0.35 . . . . 0.0 110.169 179.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.43 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 3.9 mm-40 -62.25 -34.03 75.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.491 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.466 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -68.94 -49.31 59.18 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.4 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.527 ' HG3' ' N ' ' A' ' 72' ' ' GLN . 0.5 OUTLIER -55.48 -37.9 68.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.406 -179.999 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.527 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 36.8 mt-30 -71.56 -34.27 69.83 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -41.13 98.68 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.523 179.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.4 mt -67.9 -45.15 75.21 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.22 0.533 . . . . 0.0 109.748 178.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -52.35 -41.93 63.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.662 -179.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.466 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 1.1 p -77.32 -50.58 12.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.584 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.403 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 4.0 mt -54.56 -37.73 65.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.068 -179.247 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.2 -27.39 59.58 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.553 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.4 t-20 -52.9 -50.29 82.36 Favored Pre-proline 0 CA--C 1.532 0.268 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.553 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 46.9 Cg_endo -68.8 -36.77 13.04 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.381 2.054 . . . . 0.0 112.609 -179.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.508 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 3.3 t80 -68.43 -54.42 17.22 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.008 0.433 . . . . 0.0 110.163 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 19.6 mt -57.15 -37.46 72.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.153 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.464 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -67.98 -40.74 83.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.848 0.356 . . . . 0.0 110.764 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.64 -39.63 91.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.038 0.447 . . . . 0.0 110.171 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -77.53 -38.04 49.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.931 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 14.4 ptt180 -62.46 -47.95 81.78 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.11 -39.81 95.78 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.264 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.432 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 6.1 t80 -64.56 -28.45 69.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.742 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.899 179.449 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 120.682 0.277 . . . . 0.0 110.959 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -64.74 -42.04 95.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.93 0.395 . . . . 0.0 110.08 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.402 HD23 ' HB2' ' A' ' 55' ' ' GLN . 0.9 OUTLIER -63.14 -44.83 94.46 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.659 178.959 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 37.0 mt -60.52 -54.25 37.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.436 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 79.5 p -52.18 -41.98 63.08 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-O 120.828 0.347 . . . . 0.0 110.646 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.33 -40.91 83.36 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.033 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.43 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -68.62 -27.95 73.48 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 176.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.429 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.2 OUTLIER -71.22 -61.63 1.7 Allowed 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 114.478 -0.861 . . . . 0.0 111.166 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.436 ' HG2' ' O ' ' A' ' 12' ' ' SER . 6.6 mmtm -59.19 -33.81 71.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.267 0.556 . . . . 0.0 109.951 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -62.69 -50.87 69.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.877 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.488 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -74.34 -41.75 60.55 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.849 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 80.2 p -62.27 -51.64 66.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.804 0.335 . . . . 0.0 110.662 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 54.2 t -65.86 -35.44 75.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.444 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.844 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 1.9 tp -68.9 -43.62 74.86 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.037 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 1.5 mt -69.41 -31.36 69.67 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.703 0.261 . . . . 0.0 111.703 -179.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -75.71 -28.94 58.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.516 ' C ' ' H ' ' A' ' 26' ' ' VAL . 4.1 mp0 -117.66 -51.53 2.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.324 0.583 . . . . 0.0 111.547 -179.454 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.844 ' HG3' ' O ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER 64.44 -36.18 0.18 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.778 179.074 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.516 ' H ' ' C ' ' A' ' 24' ' ' GLN . 4.7 t 80.91 109.62 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.812 0.339 . . . . 0.0 110.359 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.517 ' CZ ' ' CE1' ' A' ' 85' ' ' TYR . 20.7 m-85 . . . . . 0 CA--C 1.513 -0.462 0 CA-C-O 121.754 0.788 . . . . 0.0 111.819 -178.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 mt . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 121.09 0.471 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.431 ' CG2' ' CB ' ' A' ' 36' ' ' ASP . 13.8 p -78.59 146.51 7.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.239 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.1 p -79.73 171.69 14.79 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.077 0.465 . . . . 0.0 112.006 -178.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -63.52 -48.09 78.98 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.317 -178.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -59.24 -33.4 70.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.516 0.674 . . . . 0.0 110.117 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.431 ' CB ' ' CG2' ' A' ' 32' ' ' VAL . 1.1 m-20 -73.22 -33.25 65.25 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.055 178.121 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.53 ' HG3' ' CD2' ' A' ' 85' ' ' TYR . 0.0 OUTLIER -67.43 -47.27 70.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.451 178.27 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.8 t -55.7 -46.52 79.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.299 179.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -44.52 88.18 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.4 t -57.96 -48.15 84.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.54 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 43.1 t -59.91 -48.73 86.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.655 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.05 -45.08 75.25 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.324 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.575 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -66.41 -43.59 85.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.029 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.407 ' CZ3' HD22 ' A' ' 21' ' ' LEU . 8.3 m0 -62.25 -43.31 99.11 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.175 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.423 ' HA ' ' CD1' ' A' ' 74' ' ' LEU . 16.7 mtm -67.75 -43.62 79.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.044 -178.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -72.65 -34.87 67.57 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.235 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.575 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -65.91 -42.98 89.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.033 179.158 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -67.3 -48.32 67.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.847 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.511 ' O ' ' CG ' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -59.58 -55.42 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.405 -179.484 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.436 ' N ' ' CG2' ' A' ' 49' ' ' ILE . 11.0 t30 -60.15 -41.16 92.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.967 0.413 . . . . 0.0 110.907 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.498 ' CG ' ' OE1' ' A' ' 55' ' ' GLN . 6.3 t80 -62.33 -50.97 69.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.717 -179.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.453 ' HA ' ' OE1' ' A' ' 55' ' ' GLN . 17.4 m-85 -64.79 -30.78 71.8 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -178.424 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.511 ' CG ' ' O ' ' A' ' 49' ' ' ILE . 2.1 mtt180 -58.97 -21.53 58.75 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 119.923 -0.711 . . . . 0.0 110.447 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -100.7 -18.7 16.39 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.498 ' OE1' ' CG ' ' A' ' 51' ' ' TYR . 2.5 mt-30 -93.6 47.15 1.22 Allowed 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 120.83 -0.348 . . . . 0.0 111.141 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.496 ' HB ' ' HB3' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -128.82 165.84 27.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.312 0.577 . . . . 0.0 112.3 -179.633 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.82 171.74 14.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.204 -0.907 . . . . 0.0 108.867 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 83.7 -170.83 48.58 Favored Glycine 0 CA--C 1.516 0.154 0 C-N-CA 120.202 -0.999 . . . . 0.0 113.018 179.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.23 145.51 73.91 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-O 120.661 0.267 . . . . 0.0 111.067 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.459 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 12.0 Cg_endo -55.03 -19.96 21.84 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.931 2.421 . . . . 0.0 112.794 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.34 -40.75 77.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.798 0.332 . . . . 0.0 110.972 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.36 -47.01 71.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.39 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.496 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -60.17 -50.75 72.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.462 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -54.58 -41.18 69.57 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.999 -179.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -60.48 -49.74 76.34 Favored 'General case' 0 CA--C 1.523 -0.078 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.113 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.418 ' O ' ' HG2' ' A' ' 69' ' ' GLU . . . -57.2 -39.61 75.76 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.78 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 63' ' ' ARG . 3.6 mp -68.77 -37.98 79.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.12 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -70.81 -46.45 62.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.904 0.383 . . . . 0.0 110.271 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 66' ' ' ALA . 8.7 pt-20 -62.19 -35.93 80.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.108 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.405 ' HB3' HD13 ' A' ' 49' ' ' ILE . 0.3 OUTLIER -63.33 -49.52 73.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.74 179.404 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.7 ttt-85 -55.46 -46.28 76.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.792 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.424 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -68.11 -38.35 82.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.15 0.5 . . . . 0.0 110.127 179.403 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.45 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 3.1 tp10 -64.47 -35.92 82.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.64 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.423 ' CD1' ' HA ' ' A' ' 45' ' ' MET . 0.1 OUTLIER -68.55 -46.31 69.82 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.282 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -52.57 -39.24 61.32 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.956 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.524 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 6.8 t -80.86 -48.61 12.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.811 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.45 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 2.0 mt -58.18 -40.72 82.22 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.25 75.93 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.52 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.9 m120 -51.03 -50.37 75.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -177.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.524 ' CD ' ' O ' ' A' ' 76' ' ' THR . 55.6 Cg_endo -69.87 -27.7 25.63 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.377 2.051 . . . . 0.0 113.139 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.455 ' CE1' ' HG2' ' A' ' 25' ' ' GLN . 1.2 t80 -65.49 -53.58 40.52 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.686 0.279 . . . . 0.0 111.123 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 61.5 mt -53.39 -29.88 37.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.762 0.315 . . . . 0.0 110.441 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.89 -42.1 63.95 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -58.39 -43.19 88.43 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.564 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.53 ' CD2' ' HG3' ' A' ' 37' ' ' MET . 0.4 OUTLIER -72.38 -34.83 68.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.474 179.84 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -45.74 89.6 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -71.58 -30.02 65.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.921 178.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -70.34 -29.25 65.9 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.155 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.9 mm? . . . . . 0 C--N 1.33 -0.282 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.665 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.436 ' O ' HG23 ' A' ' 11' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.456 -0.17 0 CA-C-O 120.771 0.32 . . . . 0.0 111.015 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -71.55 -45.26 62.81 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.495 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.84 -46.64 88.61 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.484 ' CG2' ' N ' ' A' ' 12' ' ' SER . 3.7 tt -61.74 -53.73 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.828 179.208 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.484 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 8.0 t -57.38 -33.14 67.52 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-O 120.596 0.236 . . . . 0.0 111.478 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.29 78.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.287 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.449 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -71.74 -33.7 63.13 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 177.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.42 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.7 mm? -58.51 -61.16 2.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.093 -1.053 . . . . 0.0 109.51 178.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.409 ' HD2' ' CG2' ' A' ' 20' ' ' VAL . 0.4 OUTLIER -57.57 -35.48 70.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.219 0.533 . . . . 0.0 110.068 179.551 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.34 -48.57 80.7 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.536 179.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.512 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -70.57 -47.18 61.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.843 -179.944 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 89.3 p -55.49 -49.12 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.851 0.358 . . . . 0.0 110.709 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.409 ' CG2' ' HD2' ' A' ' 16' ' ' LYS . 47.8 t -68.08 -31.72 53.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.597 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.468 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 6.2 tp -66.23 -45.69 79.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.825 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 8.2 mt -68.68 -38.93 80.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.222 -179.528 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.28 -27.37 32.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.823 0.344 . . . . 0.0 111.109 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.524 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -112.04 21.56 15.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.109 -179.783 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.66 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -66.25 37.25 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -179.199 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.66 ' O ' ' O ' ' A' ' 25' ' ' GLN . 6.1 m 15.24 125.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 179.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.412 ' HB3' ' CE2' ' A' ' 88' ' ' PHE . 17.8 m-85 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.319 178.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.2 mt . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.818 0.342 . . . . 0.0 110.971 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.435 ' CG2' ' HB3' ' A' ' 36' ' ' ASP . 9.6 p -73.42 142.29 15.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.31 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.0 t -79.86 172.5 13.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.154 0.502 . . . . 0.0 111.618 -178.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.52 -40.64 89.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.918 -179.017 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -66.16 -36.83 84.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.246 0.545 . . . . 0.0 110.246 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.435 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 8.9 t0 -71.62 -35.47 70.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.485 178.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -68.37 -44.47 75.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.59 178.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.9 t -56.25 -47.44 80.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.244 179.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -59.35 -46.74 87.79 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.049 179.262 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 42.5 t -58.59 -44.59 89.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.532 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 30.9 t -62.98 -48.91 85.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.487 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.96 -44.11 70.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.49 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.456 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -67.63 -39.05 84.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.422 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.468 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 7.3 m0 -62.84 -44.98 94.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 53.2 mtm -67.13 -45.78 76.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.416 -178.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -66.52 -41.72 88.38 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.436 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.458 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -59.38 -43.35 92.91 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.875 179.177 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.505 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 7.1 m-85 -61.13 -52.0 66.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.61 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -54.43 -55.17 16.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.228 -179.295 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -64.74 -35.58 81.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.098 0.475 . . . . 0.0 110.234 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.551 ' CE1' ' NE2' ' A' ' 55' ' ' GLN . 6.3 t80 -64.8 -35.06 79.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.986 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.505 ' CE2' ' HB3' ' A' ' 48' ' ' TYR . 26.0 m-85 -75.78 -35.52 60.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.745 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.502 ' CB ' HD13 ' A' ' 67' ' ' LEU . 0.1 OUTLIER -60.65 -29.4 69.25 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.692 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -93.62 -14.8 26.04 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -178.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.551 ' NE2' ' CE1' ' A' ' 51' ' ' TYR . 3.5 mt-30 -104.89 43.72 1.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.561 ' HB ' ' CG ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -127.67 168.24 21.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.873 0.368 . . . . 0.0 111.02 178.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.6 p -139.4 171.25 14.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.825 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.65 -152.88 25.48 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.472 -0.871 . . . . 0.0 112.92 179.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.68 152.75 89.41 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-O 120.848 0.356 . . . . 0.0 111.163 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.453 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 43.7 Cg_endo -67.74 -22.33 43.58 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.737 2.291 . . . . 0.0 113.053 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -63.4 -42.02 98.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.668 -179.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.38 -39.73 81.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.257 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.561 ' CG ' ' HB ' ' A' ' 56' ' ' VAL . 1.2 mpt_? -59.32 -51.17 71.1 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.249 0.547 . . . . 0.0 109.595 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.97 -41.14 86.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.855 -179.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.48 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 9.9 tttp -68.04 -50.11 57.31 Favored 'General case' 0 C--N 1.338 0.092 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.585 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.61 -32.39 70.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.503 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.502 HD13 ' CB ' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -71.71 -40.17 69.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.435 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.524 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 3.0 pt20 -66.62 -36.84 83.56 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.524 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.2 tt0 -69.24 -35.09 75.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.002 179.259 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.463 ' CD1' ' CD2' ' A' ' 52' ' ' TYR . 4.0 mt -65.49 -49.27 69.68 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.45 -48.89 73.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.317 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.503 ' HG2' ' HA ' ' A' ' 69' ' ' GLU . 7.7 pt20 -64.14 -36.52 84.3 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 178.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 2.9 tp10 -63.08 -37.22 86.34 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.512 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.43 HD22 ' CE2' ' A' ' 18' ' ' PHE . 23.9 mt -68.16 -45.68 72.83 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.3 m120 -52.95 -38.46 62.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.863 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.441 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 5.6 t -80.86 -49.3 11.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.508 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.8 mt -56.44 -35.25 67.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.205 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.62 -31.67 62.06 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.54 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.2 t-20 -51.65 -50.16 78.81 Favored Pre-proline 0 CA--C 1.533 0.319 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 55.5 Cg_endo -69.84 -32.33 18.43 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.442 2.095 . . . . 0.0 113.119 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.504 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 6.2 t80 -65.89 -53.67 36.6 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.886 0.374 . . . . 0.0 110.914 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.6 mt -56.33 -31.31 63.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.756 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 86' ' ' ARG . . . -69.08 -46.18 68.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.834 0.35 . . . . 0.0 110.392 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -58.02 -42.47 85.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.698 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.41 ' OH ' ' CG1' ' A' ' 32' ' ' VAL . 0.5 OUTLIER -73.03 -33.55 65.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.0 -179.933 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.517 ' HG3' ' N ' ' A' ' 87' ' ' ASP . 0.0 OUTLIER -63.03 -39.4 94.62 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.935 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.517 ' N ' ' HG3' ' A' ' 86' ' ' ARG . 6.7 m-20 -72.8 -32.44 65.56 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.029 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.412 ' CE2' ' HB3' ' A' ' 27' ' ' PHE . 7.7 t80 -71.14 -28.92 64.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.713 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.456 179.165 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.493 ' O ' HG21 ' A' ' 11' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.772 0.32 . . . . 0.0 110.954 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.87 -45.25 52.11 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.47 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.6 tp -61.63 -46.38 90.03 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.106 0.479 . . . . 0.0 109.713 178.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.493 HG21 ' O ' ' A' ' 8' ' ' LYS . 2.6 tt -61.36 -53.6 46.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.648 179.009 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.492 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 6.6 t -52.12 -33.09 38.33 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.909 0.385 . . . . 0.0 110.554 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -67.79 -41.72 82.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.75 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.496 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -70.88 -35.98 65.56 Favored Glycine 0 C--O 1.23 -0.141 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mp -59.75 -61.01 2.93 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 113.829 -1.186 . . . . 0.0 109.929 179.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.429 ' HD2' ' CG2' ' A' ' 20' ' ' VAL . 1.3 tptp -59.06 -37.09 76.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.229 0.538 . . . . 0.0 110.253 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 6.7 tp10 -61.3 -46.85 88.58 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.386 179.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.466 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.3 OUTLIER -71.12 -49.32 45.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.1 -179.781 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 91.3 p -55.85 -46.36 78.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.907 0.385 . . . . 0.0 110.419 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.477 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 63.0 t -68.32 -32.91 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.392 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.424 HD23 ' CZ2' ' A' ' 44' ' ' TRP . 6.6 tp -62.62 -45.98 90.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.793 0.33 . . . . 0.0 110.587 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.529 ' CD2' ' CD2' ' A' ' 81' ' ' PHE . 9.8 mt -72.95 -30.59 63.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.612 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -82.66 -30.14 29.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.542 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.477 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 1.0 OUTLIER -107.91 9.92 28.61 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.473 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.38 160.22 0.17 Allowed 'General case' 0 C--O 1.232 0.184 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 177.229 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 11.3 p -112.08 138.14 42.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 119.931 1.241 . . . . 0.0 110.158 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.455 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.4 m-85 . . . . . 0 C--N 1.326 -0.454 0 CA-C-O 121.524 0.678 . . . . 0.0 110.591 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 18.2 mt . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.911 0.386 . . . . 0.0 110.817 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.2 p -73.15 140.38 17.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.777 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.7 p -80.04 173.77 12.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.107 0.48 . . . . 0.0 111.856 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.81 -44.38 96.32 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.082 -179.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.32 -36.89 84.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.124 0.488 . . . . 0.0 110.542 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -71.55 -36.49 70.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.343 178.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 5.3 tpt -66.91 -45.0 79.31 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.436 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 77.8 t -55.6 -45.91 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.16 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.026 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -45.45 91.1 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.049 0.452 . . . . 0.0 109.865 178.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.404 ' HA ' ' OD2' ' A' ' 43' ' ' ASP . 36.7 t -55.64 -47.66 78.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.015 179.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.4 t -68.41 -41.69 83.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.799 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -56.24 -47.17 79.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.975 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.532 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 2.8 p30 -71.56 -34.66 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.246 179.539 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.424 ' CZ2' HD23 ' A' ' 21' ' ' LEU . 2.5 m0 -61.76 -46.61 88.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.418 0.627 . . . . 0.0 110.26 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.464 ' HG2' ' N ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -70.91 -36.6 72.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.125 -178.918 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.464 ' N ' ' HG2' ' A' ' 45' ' ' MET . 5.0 t30 -73.6 -39.83 64.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.959 0.409 . . . . 0.0 109.936 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.532 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.88 -45.76 91.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.728 179.438 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.468 ' CE1' ' CZ ' ' A' ' 47' ' ' PHE . 6.8 m-85 -64.71 -46.23 83.19 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.644 179.753 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 3.5 mm -55.18 -55.17 17.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.147 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -68.76 -37.69 79.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.955 0.407 . . . . 0.0 110.921 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.446 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.7 t80 -61.93 -43.07 99.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.91 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.757 ' O ' HG21 ' A' ' 56' ' ' VAL . 24.0 m-85 -75.66 -30.86 59.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.94 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.447 ' HA ' HD13 ' A' ' 67' ' ' LEU . 27.0 ttm105 -61.57 -30.53 70.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.998 0.428 . . . . 0.0 110.411 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -103.49 -10.97 18.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.397 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.466 ' O ' ' HG3' ' A' ' 55' ' ' GLN . 9.5 tp-100 -96.33 21.85 8.53 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.757 HG21 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -102.12 174.06 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.138 0.494 . . . . 0.0 111.638 -179.599 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.0 p -143.8 171.43 14.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.433 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 83.66 -151.74 28.15 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.302 -0.951 . . . . 0.0 113.08 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.472 ' O ' ' HD3' ' A' ' 63' ' ' ARG . 13.8 mm-40 -75.15 159.45 82.5 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-O 120.726 0.298 . . . . 0.0 111.158 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -67.6 -29.06 37.22 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.794 2.329 . . . . 0.0 113.861 -178.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.532 ' HG2' ' N ' ' A' ' 62' ' ' GLU . 8.8 pm0 -66.16 -39.13 89.54 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.945 0.403 . . . . 0.0 111.021 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.532 ' N ' ' HG2' ' A' ' 61' ' ' GLN . 18.3 mt-10 -64.17 -46.68 82.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.19 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.634 ' HD2' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.61 -50.89 68.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.222 0.534 . . . . 0.0 109.611 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -55.46 -41.68 73.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.67 -178.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.418 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 8.5 mttt -61.69 -49.93 74.52 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.477 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.412 ' HA ' ' HG2' ' A' ' 69' ' ' GLU . . . -57.4 -35.84 70.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.857 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 53' ' ' ARG . 6.6 mp -68.78 -37.93 79.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.434 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.443 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 0.0 OUTLIER -70.68 -43.82 68.29 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 179.538 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.443 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 9.1 pt-20 -67.65 -26.55 66.28 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.244 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.406 HD21 HD13 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -69.55 -49.49 53.85 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.443 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.39 -48.84 73.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.785 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.49 -33.88 73.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.164 0.507 . . . . 0.0 109.88 179.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -58.86 -48.23 82.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.656 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.6 mt -67.45 -42.96 82.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.983 0.42 . . . . 0.0 110.341 178.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -52.29 -40.83 62.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.915 -179.136 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.7 m -81.0 -50.7 9.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.156 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.415 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 0.5 OUTLIER -57.0 -34.57 68.27 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.355 -179.07 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.3 -30.09 60.26 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 -178.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.548 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -51.74 -49.74 81.56 Favored Pre-proline 0 CA--C 1.535 0.389 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.237 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.548 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.5 Cg_endo -69.54 -36.63 11.04 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.416 2.077 . . . . 0.0 113.235 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.529 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 13.6 t80 -65.04 -53.63 42.86 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.992 0.425 . . . . 0.0 110.415 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 20.1 mt -58.2 -29.43 65.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.588 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -66.41 -48.87 68.68 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 110.155 179.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -57.21 -49.14 76.93 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.567 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.423 ' CD2' HD22 ' A' ' 89' ' ' LEU . 0.3 OUTLIER -67.74 -33.41 74.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.693 179.854 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.69 -38.07 88.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.163 0.506 . . . . 0.0 109.654 178.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.84 -31.08 64.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.739 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -73.23 -37.25 66.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.452 179.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.423 HD22 ' CD2' ' A' ' 85' ' ' TYR . 3.9 mm? . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.131 178.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.788 0.327 . . . . 0.0 110.734 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -70.63 -45.15 65.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.598 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.401 HD13 ' CG ' ' A' ' 55' ' ' GLN . 0.3 OUTLIER -60.07 -46.18 90.44 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.273 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.412 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 41.1 mm -61.82 -54.28 36.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.079 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.0 t -61.31 -33.07 72.99 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.69 -43.93 75.04 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.945 -179.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.671 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -70.85 -42.3 61.05 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 177.255 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 11' ' ' ILE . 2.1 mt -54.34 -58.7 6.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 113.813 -1.193 . . . . 0.0 109.745 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.7 tttm -61.77 -31.97 72.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.139 0.495 . . . . 0.0 109.851 179.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.49 -48.54 80.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.252 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.48 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -72.82 -50.24 25.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.754 -179.904 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.1 m -55.41 -51.31 67.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.987 0.423 . . . . 0.0 110.173 179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.414 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 95.6 t -65.03 -32.39 58.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.233 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.402 HD23 ' CH2' ' A' ' 44' ' ' TRP . 3.7 tp -64.19 -45.92 86.22 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.612 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.5 HD21 ' CD2' ' A' ' 81' ' ' PHE . 1.7 mt -66.65 -36.01 81.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.008 0.432 . . . . 0.0 110.129 179.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -82.59 -18.18 42.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.188 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.414 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 7.6 mt-30 -107.48 12.24 28.03 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.479 ' HG3' ' CZ ' ' A' ' 81' ' ' PHE . 1.9 mm-40 -50.14 161.97 0.24 Allowed 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 178.003 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.5 t -109.23 132.08 58.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 119.107 0.867 . . . . 0.0 111.102 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.412 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 5.4 m-85 . . . . . 0 C--N 1.323 -0.584 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.71 179.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.443 HD12 ' CZ ' ' A' ' 88' ' ' PHE . 6.4 mt . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.98 0.419 . . . . 0.0 111.335 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.41 ' CG2' ' CB ' ' A' ' 36' ' ' ASP . 10.2 p -73.88 154.23 6.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.84 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.81 170.06 17.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.253 0.549 . . . . 0.0 112.117 -178.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.3 -29.52 68.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.591 -179.2 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -34.06 76.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.077 0.465 . . . . 0.0 110.279 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.41 ' CB ' ' CG2' ' A' ' 32' ' ' VAL . 0.3 OUTLIER -71.7 -40.78 69.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.917 179.232 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.406 ' SD ' ' CD2' ' A' ' 85' ' ' TYR . 0.9 OUTLIER -64.63 -45.59 86.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.754 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.1 t -55.66 -48.16 78.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.875 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -44.86 95.6 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.228 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.418 HG11 ' CD2' ' A' ' 44' ' ' TRP . 53.4 t -59.05 -43.61 89.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.684 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.6 t -67.08 -48.83 77.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.57 179.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -50.86 71.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.381 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.487 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.7 OUTLIER -60.14 -41.64 93.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.168 179.316 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.418 ' CD2' HG11 ' A' ' 40' ' ' VAL . 8.4 m0 -60.75 -43.75 97.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.409 179.372 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -61.54 -50.67 71.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.228 -178.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -68.32 -36.84 79.9 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.487 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.75 -41.15 90.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.783 179.177 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.468 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 4.8 m-85 -70.78 -48.37 54.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.835 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.5 mm -53.86 -55.05 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.302 -179.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -68.65 -34.52 75.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.838 0.352 . . . . 0.0 110.966 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.454 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 3.0 t80 -65.36 -44.34 87.95 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.938 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.671 ' OH ' ' HA2' ' A' ' 14' ' ' GLY . 58.8 m-85 -75.43 -33.39 60.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.59 -179.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 29.7 ttm-85 -61.38 -31.22 71.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.664 0.269 . . . . 0.0 111.476 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -96.2 -9.54 30.24 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.573 ' O ' ' HG3' ' A' ' 55' ' ' GLN . 4.0 pt20 -113.48 35.47 4.01 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -178.602 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -111.75 156.33 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 177.786 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.4 p -122.25 169.84 10.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.82 0.343 . . . . 0.0 110.883 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 91.19 -152.35 21.58 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.505 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.95 163.73 66.19 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 120.765 0.316 . . . . 0.0 110.885 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.44 -27.72 39.58 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.616 2.21 . . . . 0.0 112.547 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -41.91 94.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.96 0.409 . . . . 0.0 110.92 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.77 -46.65 84.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.467 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.467 ' HD3' ' HB ' ' A' ' 56' ' ' VAL . 17.4 mtt85 -55.32 -51.18 67.58 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.255 0.55 . . . . 0.0 109.865 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -55.83 -41.45 74.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.541 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -60.18 -49.9 75.79 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.06 0.457 . . . . 0.0 110.3 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.19 68.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.413 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.5 mp -67.5 -39.98 85.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.401 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -70.29 -45.67 65.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.123 0.487 . . . . 0.0 110.012 179.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.413 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 2.7 mt-10 -62.87 -32.93 74.27 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.239 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.466 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 0.3 OUTLIER -65.97 -49.32 68.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.148 0.499 . . . . 0.0 109.683 179.247 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -55.26 -46.18 76.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.728 -179.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.466 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -69.43 -31.89 70.51 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.089 0.471 . . . . 0.0 110.068 179.09 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.466 ' N ' ' HG3' ' A' ' 72' ' ' GLN . 1.0 OUTLIER -61.82 -45.97 91.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.839 179.584 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.448 ' CD2' ' CE2' ' A' ' 18' ' ' PHE . 1.8 mt -67.36 -44.69 78.39 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 121.157 0.503 . . . . 0.0 110.315 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 26.6 m120 -52.46 -41.2 63.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.855 -179.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.402 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -80.84 -50.56 9.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.037 179.615 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 4.7 mt -56.21 -34.58 66.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.062 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.08 -28.98 61.64 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.55 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 10.6 t30 -53.84 -50.28 84.67 Favored Pre-proline 0 C--N 1.328 -0.333 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.55 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 42.1 Cg_endo -68.29 -39.37 10.16 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.474 2.116 . . . . 0.0 113.222 -179.358 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.5 ' CD2' HD21 ' A' ' 22' ' ' LEU . 5.7 t80 -63.81 -53.53 49.35 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.231 0.538 . . . . 0.0 110.565 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.41 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 88.3 mt -57.57 -31.5 66.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.794 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.456 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -68.3 -45.2 73.66 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.961 0.41 . . . . 0.0 110.772 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -59.62 -41.86 91.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.059 0.457 . . . . 0.0 110.587 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.415 ' O ' ' HG ' ' A' ' 89' ' ' LEU . 0.2 OUTLIER -77.57 -35.71 52.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.691 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 22.3 ptt180 -64.17 -39.49 94.12 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.568 -0.453 . . . . 0.0 109.819 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.59 -36.99 68.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.72 178.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.443 ' CZ ' HD12 ' A' ' 31' ' ' LEU . 4.5 t80 -69.6 -29.24 66.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.486 179.098 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 85' ' ' TYR . 6.2 mt . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.479 178.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.814 0.34 . . . . 0.0 110.551 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.77 -44.51 89.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.086 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.91 -46.54 89.04 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.226 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.4 ' HA ' ' HE2' ' A' ' 52' ' ' TYR . 35.3 mm -57.79 -53.75 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.821 178.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.506 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 25.1 p -53.0 -42.87 66.02 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.285 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.4 91.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.557 0.218 . . . . 0.0 111.261 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.457 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -69.91 -28.03 72.38 Favored Glycine 0 CA--C 1.518 0.227 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 177.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.434 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.4 OUTLIER -67.35 -61.48 1.89 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.211 -0.994 . . . . 0.0 110.691 179.452 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 12' ' ' SER . 5.1 mmtt -59.69 -39.18 83.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.308 0.575 . . . . 0.0 109.634 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -59.37 -50.64 73.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.956 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.52 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -69.85 -42.7 73.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.985 -179.756 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.46 -51.06 71.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.991 0.424 . . . . 0.0 110.426 179.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.409 ' O ' ' N ' ' A' ' 24' ' ' GLN . 61.1 t -63.29 -33.55 61.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.657 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.436 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 34.9 tp -62.37 -46.14 89.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.826 0.346 . . . . 0.0 110.777 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 36.7 mt -66.25 -41.29 90.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.073 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -80.03 -21.21 43.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.429 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.514 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -117.55 21.48 12.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.223 -179.691 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.653 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.1 OUTLIER -66.93 36.55 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.118 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.653 ' O ' ' O ' ' A' ' 25' ' ' GLN . 22.4 m 8.45 127.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 . . . . . 0 C--N 1.328 -0.366 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.211 178.606 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.415 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.0 OUTLIER . . . . . 0 N--CA 1.462 0.153 0 CA-C-O 121.049 0.452 . . . . 0.0 112.172 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.402 ' CG2' ' CB ' ' A' ' 36' ' ' ASP . 11.1 p -76.46 152.67 5.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.024 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.0 m -79.97 172.19 14.1 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.204 0.526 . . . . 0.0 111.912 -178.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -66.64 -40.74 88.84 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.221 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -37.01 85.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.109 0.48 . . . . 0.0 110.461 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.402 ' CB ' ' CG2' ' A' ' 32' ' ' VAL . 5.0 m-20 -71.91 -35.73 69.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.511 178.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 5.5 tpt -67.16 -45.55 76.7 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.506 178.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 49.1 t -55.67 -46.74 79.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.232 179.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -46.87 85.01 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.162 179.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 25.5 t -55.83 -51.52 59.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.651 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 32.0 t -58.08 -46.42 88.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.544 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.71 -47.09 74.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.466 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.515 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 1.0 OUTLIER -56.83 -48.58 77.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.948 179.833 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.436 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 33.2 m0 -60.76 -42.27 97.12 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.122 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.9 ttp -61.86 -50.96 70.17 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.196 -0.457 . . . . 0.0 112.042 -178.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -72.62 -29.6 63.61 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.515 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 1.1 t80 -64.02 -45.47 88.78 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.832 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -69.49 -42.62 74.53 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.306 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 15.1 mm -54.14 -55.29 15.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.197 -179.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.529 ' HA ' ' HG2' ' A' ' 53' ' ' ARG . 13.0 m-80 -66.64 -34.87 78.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.301 0.572 . . . . 0.0 110.171 179.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.454 ' CE1' ' HG2' ' A' ' 55' ' ' GLN . 6.6 t80 -62.78 -40.22 96.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.044 179.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.457 ' OH ' ' HA2' ' A' ' 14' ' ' GLY . 5.3 m-85 -75.47 -38.71 59.43 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -178.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.529 ' HG2' ' HA ' ' A' ' 50' ' ' ASN . 4.8 ptp85 -58.75 -31.64 68.52 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.122 -179.393 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -91.49 -11.38 37.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.591 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.454 ' HG2' ' CE1' ' A' ' 51' ' ' TYR . 2.5 mp0 -96.58 -18.62 19.64 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.134 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.578 ' HB ' ' HG3' ' A' ' 63' ' ' ARG . 14.5 t -68.78 160.39 4.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.08 0.467 . . . . 0.0 111.886 -179.257 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.4 p -133.88 171.11 14.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.509 179.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 90.9 -151.08 20.95 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.934 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.11 162.91 65.25 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.707 0.289 . . . . 0.0 110.984 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -60.98 -28.34 86.14 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.715 2.277 . . . . 0.0 112.761 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -43.29 99.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.131 0.491 . . . . 0.0 110.679 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.23 -46.66 88.99 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.211 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.578 ' HG3' ' HB ' ' A' ' 56' ' ' VAL . 3.7 mpt_? -54.04 -51.19 64.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.05 0.452 . . . . 0.0 110.014 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.43 -41.97 73.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.314 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.405 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 2.2 ttmm -66.66 -32.06 73.14 Favored 'General case' 0 CA--C 1.523 -0.069 0 O-C-N 122.082 -0.386 . . . . 0.0 110.852 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -71.07 -38.33 72.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.464 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.432 HD13 ' CA ' ' A' ' 53' ' ' ARG . 8.9 mp -70.03 -35.05 74.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.588 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 3.3 pp0? -73.81 -46.35 45.81 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.373 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -62.34 -35.65 79.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.522 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.432 HD22 ' CD1' ' A' ' 52' ' ' TYR . 2.1 tp -66.09 -49.02 69.02 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.111 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -55.23 -45.65 75.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.796 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.04 -33.53 65.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.041 0.448 . . . . 0.0 110.056 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.77 -48.0 83.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.752 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.5 mt -67.67 -44.8 76.96 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.931 0.396 . . . . 0.0 110.535 178.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -52.69 -40.17 62.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.326 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.1 t -80.87 -34.73 33.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.265 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.427 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 0.6 OUTLIER -72.97 -30.16 63.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.996 -179.276 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.26 -29.4 60.16 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.551 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 15.3 m-20 -54.76 -50.23 87.06 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.551 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.2 Cg_endo -69.78 -37.87 8.52 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.459 2.106 . . . . 0.0 112.74 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.493 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 1.8 t80 -62.75 -53.42 54.58 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 110.415 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 93.2 mt -55.03 -27.64 46.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.283 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.47 -45.46 62.49 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.457 179.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -56.86 -42.94 80.65 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.146 0.498 . . . . 0.0 109.925 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.34 -33.39 61.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.445 179.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -44.49 96.28 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.24 -33.55 69.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.007 178.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.415 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 2.9 t80 -71.49 -28.91 64.24 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.017 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.421 179.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 120.803 0.335 . . . . 0.0 110.568 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -65.15 -42.63 93.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.155 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.555 ' CD1' ' CD2' ' A' ' 52' ' ' TYR . 0.2 OUTLIER -59.72 -48.22 82.53 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.717 179.324 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 41.0 mm -59.13 -53.79 43.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.073 178.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 72.3 m -57.21 -33.11 67.18 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.011 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.17 91.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.183 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.499 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -69.75 -41.87 72.7 Favored Glycine 0 CA--C 1.511 -0.201 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 177.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.4 -58.9 5.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 113.824 -1.188 . . . . 0.0 109.624 178.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -30.92 69.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.373 179.465 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.33 -47.26 74.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.449 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.538 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -71.32 -46.11 61.42 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.71 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 82.9 p -55.51 -51.6 66.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 0.0 110.749 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 48.3 t -66.59 -33.27 62.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.967 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.446 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 2.6 tp -66.76 -45.78 77.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.01 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.564 HD21 ' CD2' ' A' ' 81' ' ' PHE . 4.5 mt -68.23 -35.11 77.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.855 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.47 -34.24 31.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.91 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -104.8 18.81 21.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.233 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.49 ' O ' ' CB ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -39.37 -59.37 1.08 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.762 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.49 ' CB ' ' O ' ' A' ' 25' ' ' GLN . 42.4 t 98.92 130.19 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.534 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.448 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.1 m-85 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.979 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.9 mt . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.963 0.411 . . . . 0.0 111.114 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 11.6 p -74.55 144.92 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.825 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.86 173.36 12.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.085 0.469 . . . . 0.0 111.734 -178.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.61 -42.81 95.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.141 -179.121 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -66.07 -37.25 85.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.071 0.462 . . . . 0.0 110.756 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -71.57 -37.84 71.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.819 179.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 1.4 tpt -67.91 -45.14 75.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.704 178.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 96.1 t -56.41 -44.14 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.448 179.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -45.57 92.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.924 0.392 . . . . 0.0 110.142 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 39.2 t -60.11 -44.23 94.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.533 179.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.44 HG23 ' CE2' ' A' ' 81' ' ' PHE . 38.8 t -65.06 -49.11 81.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.62 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.83 -42.94 80.54 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.237 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.26 -41.0 92.33 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.071 0.462 . . . . 0.0 109.774 179.022 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.446 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 10.7 m0 -60.52 -39.35 87.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.249 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.45 ' HA ' ' CD1' ' A' ' 74' ' ' LEU . 52.0 mtm -68.07 -45.99 72.3 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -178.579 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -34.35 73.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.03 0.443 . . . . 0.0 110.07 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.449 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -62.8 -46.19 89.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.098 179.32 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -66.61 -47.39 72.79 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.12 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -55.31 -55.09 18.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.027 -179.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.466 ' HA ' ' HG2' ' A' ' 53' ' ' ARG . 8.0 m-80 -66.68 -36.85 83.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.131 0.491 . . . . 0.0 110.727 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.449 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 4.7 t80 -64.65 -39.27 93.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.142 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.555 ' CD2' ' CD1' ' A' ' 10' ' ' LEU . 7.5 m-85 -75.64 -36.75 60.1 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.466 ' HG2' ' HA ' ' A' ' 50' ' ' ASN . 8.8 ptp180 -58.13 -28.48 64.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.089 0.471 . . . . 0.0 110.8 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -95.49 -8.57 34.91 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.596 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -95.7 -7.83 36.3 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.58 ' HB ' ' HD2' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -85.14 178.29 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.172 0.511 . . . . 0.0 111.715 -178.962 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.0 p -144.91 171.4 14.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.288 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.85 -144.85 19.72 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.901 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -79.17 163.69 58.48 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.724 0.297 . . . . 0.0 110.975 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.415 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 45.4 Cg_endo -67.7 -22.74 43.22 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.666 2.244 . . . . 0.0 112.777 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.17 -43.13 92.71 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.938 0.399 . . . . 0.0 110.733 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -60.82 -44.58 96.73 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.081 179.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.58 ' HD2' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.52 -50.96 68.6 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.225 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -55.28 -41.94 72.95 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.535 -178.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.436 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 0.8 OUTLIER -66.33 -34.41 77.93 Favored 'General case' 0 C--O 1.231 0.101 0 O-C-N 122.103 -0.373 . . . . 0.0 110.955 -179.819 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.468 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -69.48 -38.48 77.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.089 0.471 . . . . 0.0 110.032 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.442 HD13 ' CA ' ' A' ' 53' ' ' ARG . 8.1 mp -68.45 -35.94 78.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.395 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 6.0 pt20 -76.08 -48.91 19.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.811 0.338 . . . . 0.0 110.815 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.421 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.2 mt-10 -61.98 -41.98 98.63 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.519 -179.543 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.468 ' HB2' ' O ' ' A' ' 66' ' ' ALA . 9.5 tp -66.68 -49.1 67.2 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.73 -43.27 76.44 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.431 179.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.4 -41.25 76.67 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.158 0.504 . . . . 0.0 109.65 179.111 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -58.55 -39.41 80.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.601 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.45 ' CD1' ' HA ' ' A' ' 45' ' ' MET . 1.3 mt -67.98 -45.53 73.91 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.202 0.525 . . . . 0.0 109.813 178.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -52.52 -37.19 56.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.563 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.425 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -80.83 -50.6 9.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.69 179.148 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.403 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 3.8 mt -57.81 -35.02 70.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.506 -178.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.16 -30.89 60.86 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.546 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.0 OUTLIER -51.52 -49.97 79.48 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.086 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.546 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 51.1 Cg_endo -69.4 -34.1 16.52 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.43 2.087 . . . . 0.0 112.961 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.564 ' CD2' HD21 ' A' ' 22' ' ' LEU . 3.3 t80 -66.97 -53.85 27.64 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.902 0.382 . . . . 0.0 110.22 179.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 90.6 mt -60.6 -27.57 67.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.783 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.508 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -70.25 -42.67 71.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.051 0.453 . . . . 0.0 110.465 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.69 -42.9 94.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.299 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -72.66 -42.71 64.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.519 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.508 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 9.1 ptm180 -59.84 -35.4 74.67 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.449 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.55 -35.32 67.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.343 178.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -69.89 -28.55 65.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.004 179.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.6 mm? . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.141 179.202 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.733 0.301 . . . . 0.0 110.713 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.92 -45.0 83.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.48 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.7 tp -60.81 -46.09 91.88 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.211 0.529 . . . . 0.0 109.691 179.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 mt -60.48 -53.81 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.962 178.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.404 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 4.1 m -55.2 -33.65 63.22 Favored 'General case' 0 C--O 1.227 -0.107 0 CA-C-O 120.912 0.387 . . . . 0.0 110.468 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.06 -41.34 95.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.588 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.463 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -70.39 -40.41 69.09 Favored Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 109.126 -1.59 . . . . 0.0 109.126 176.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.404 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.3 OUTLIER -54.64 -60.02 3.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.908 -1.146 . . . . 0.0 110.454 179.135 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.7 tttm -60.8 -34.65 74.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.164 0.507 . . . . 0.0 110.092 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.44 -47.76 84.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.214 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.55 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -69.81 -50.31 44.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.852 -179.76 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 61.6 m -55.44 -51.6 66.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.05 0.452 . . . . 0.0 110.836 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.3 t -63.66 -33.76 63.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.646 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.438 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 1.0 OUTLIER -66.24 -45.95 78.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.647 179.878 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 2.6 mt -61.93 -37.75 85.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.015 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -82.52 -19.29 38.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.034 179.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.451 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -109.58 21.28 17.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.425 -179.683 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.801 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.8 OUTLIER -74.31 29.45 0.08 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.295 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.801 ' O ' ' O ' ' A' ' 25' ' ' GLN . 22.9 t 19.78 133.31 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 N-CA-C 113.815 1.042 . . . . 0.0 113.815 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 . . . . . 0 C--N 1.33 -0.241 0 CA-C-O 121.245 0.545 . . . . 0.0 110.804 178.854 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 9.8 mt . . . . . 0 N--CA 1.456 -0.144 0 CA-C-O 121.037 0.446 . . . . 0.0 111.116 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 11.5 p -74.82 148.04 8.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.86 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.8 m -79.88 172.46 13.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.073 0.463 . . . . 0.0 111.671 -178.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.407 ' HB3' ' CD2' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -70.32 -29.34 66.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.355 -179.442 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.56 -36.57 78.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.983 0.42 . . . . 0.0 110.436 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.11 -36.68 64.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.912 -0.586 . . . . 0.0 109.703 178.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.412 ' HG2' ' CD2' ' A' ' 85' ' ' TYR . 2.5 tpt -67.74 -47.29 69.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.615 178.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 92.3 t -56.27 -46.06 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.167 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -58.36 -47.15 84.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.137 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 42.6 t -59.0 -40.92 81.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.759 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 20.3 t -67.32 -48.88 76.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.696 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.96 -46.27 78.63 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.529 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.495 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -64.39 -41.14 96.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.55 179.542 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.438 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 7.5 m0 -60.83 -42.88 98.6 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.777 179.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 4.6 ttp -68.17 -43.53 78.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.299 -178.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -72.42 -34.05 67.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.896 0.379 . . . . 0.0 110.054 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.495 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.03 -43.81 97.67 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.116 179.441 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -69.09 -45.72 69.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.334 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.603 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 2.0 mm -55.25 -55.7 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.364 -179.273 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.428 ' HA ' ' HD2' ' A' ' 53' ' ' ARG . 20.8 m-80 -65.5 -36.28 83.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.145 0.498 . . . . 0.0 110.731 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.513 ' CD1' ' HG3' ' A' ' 55' ' ' GLN . 0.7 OUTLIER -62.19 -45.61 92.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.517 -179.497 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.463 ' OH ' ' HA2' ' A' ' 14' ' ' GLY . 17.3 m-85 -76.01 -33.46 59.68 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -178.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.603 ' HG3' ' O ' ' A' ' 49' ' ' ILE . 0.8 OUTLIER -63.53 -24.99 68.05 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 119.849 -0.741 . . . . 0.0 110.755 -179.697 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -98.79 -16.01 19.07 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.513 ' HG3' ' CD1' ' A' ' 51' ' ' TYR . 7.0 mm-40 -102.09 45.85 0.95 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.57 ' HB ' ' CD ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -125.0 173.54 10.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.173 0.511 . . . . 0.0 111.496 179.353 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.435 ' O ' ' NE ' ' A' ' 63' ' ' ARG . 12.1 p -144.17 171.16 14.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.183 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.49 -155.52 30.97 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.2 -1.0 . . . . 0.0 112.891 179.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.46 ' O ' ' NE ' ' A' ' 63' ' ' ARG . 1.4 mt-10 -67.9 144.76 97.5 Favored Pre-proline 0 C--N 1.333 -0.15 0 CA-C-O 120.755 0.312 . . . . 0.0 111.221 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.404 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 42.3 Cg_endo -67.45 -25.64 41.46 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.784 2.323 . . . . 0.0 113.084 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.56 -43.89 95.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.13 0.49 . . . . 0.0 110.886 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.419 ' HB2' ' NH2' ' A' ' 63' ' ' ARG . 1.8 mt-10 -60.71 -43.36 97.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.045 179.344 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.608 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -55.26 -51.39 66.79 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.298 0.57 . . . . 0.0 109.605 179.219 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.33 -41.49 72.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.705 -178.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.407 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 0.2 OUTLIER -63.25 -49.78 72.76 Favored 'General case' 0 CA--C 1.523 -0.081 0 C-N-CA 119.941 -0.704 . . . . 0.0 110.328 179.888 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.94 -40.91 90.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.307 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.608 HD12 ' O ' ' A' ' 63' ' ' ARG . 2.4 mp -61.96 -45.89 91.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.459 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.478 ' O ' ' HG2' ' A' ' 71' ' ' ARG . 2.2 pp0? -66.72 -38.23 86.27 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.189 0.519 . . . . 0.0 110.06 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.89 -30.89 71.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.545 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.9 mt -71.02 -49.84 40.62 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.141 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 6.7 ptt85 -56.4 -40.26 74.35 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.444 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 1.1 mt-30 -72.9 -35.91 67.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.227 0.537 . . . . 0.0 109.555 178.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -45.48 94.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.093 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.416 HD21 ' CE2' ' A' ' 18' ' ' PHE . 11.5 mt -67.87 -45.08 75.53 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.121 0.486 . . . . 0.0 110.329 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.7 -38.17 60.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.756 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.402 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 2.6 p -80.86 -50.7 9.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.137 0.494 . . . . 0.0 110.624 179.212 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.404 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 4.4 mt -56.59 -33.01 65.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.148 -179.196 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.19 -31.02 60.83 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.544 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.4 OUTLIER -51.85 -50.23 79.14 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.228 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.544 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 52.5 Cg_endo -69.73 -33.98 15.6 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.522 2.148 . . . . 0.0 113.177 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.519 ' CD2' HD21 ' A' ' 22' ' ' LEU . 2.2 t80 -66.15 -53.56 36.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.982 0.42 . . . . 0.0 110.505 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.8 mt -58.31 -29.02 65.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.796 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.9 -47.94 60.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.87 0.367 . . . . 0.0 110.475 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -41.42 84.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.527 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.412 ' CD2' ' HG2' ' A' ' 37' ' ' MET . 0.3 OUTLIER -76.19 -33.41 59.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.759 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 mmt-85 -67.11 -40.5 86.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.045 0.45 . . . . 0.0 110.098 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.66 -36.89 68.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.926 179.057 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -72.46 -28.78 63.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.676 179.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.407 ' CD2' ' HB3' ' A' ' 34' ' ' GLU . 2.2 mp . . . . . 0 C--N 1.326 -0.423 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.808 0.337 . . . . 0.0 111.213 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 61.64 116.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.016 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.3 -17.47 62.57 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.991 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.67 -46.66 88.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.92 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -62.69 -56.0 21.7 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.047 0.451 . . . . 0.0 110.232 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 mtpt -58.42 -30.78 67.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.618 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.61 -44.45 82.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.196 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.2 tp -60.04 -45.1 93.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.783 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 43.6 mm -60.49 -54.23 38.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.878 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.8 m -51.92 -33.06 35.49 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.869 0.366 . . . . 0.0 110.697 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.76 -44.42 77.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.241 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.437 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -69.2 -28.22 72.97 Favored Glycine 0 N--CA 1.451 -0.365 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 177.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -70.08 -61.37 1.8 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.52 -0.84 . . . . 0.0 110.253 179.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.8 ttpm? -59.3 -36.07 74.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.985 0.421 . . . . 0.0 110.086 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -60.58 -49.39 77.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.275 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.499 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -71.26 -49.31 44.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.391 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.3 m -55.36 -51.55 66.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.966 0.413 . . . . 0.0 110.802 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.445 ' O ' ' CB ' ' A' ' 24' ' ' GLN . 46.3 t -66.45 -34.95 73.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.065 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.45 HD23 ' CD2' ' A' ' 44' ' ' TRP . 0.5 OUTLIER -65.88 -46.21 79.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.641 0.258 . . . . 0.0 111.199 -179.741 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.509 ' CD2' ' CD2' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -64.38 -40.91 96.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.951 0.405 . . . . 0.0 110.358 179.857 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -82.78 -17.25 44.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.149 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.445 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -105.35 6.98 33.13 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.851 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -50.77 162.23 0.28 Allowed 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 177.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.7 p -108.24 133.87 51.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 119.322 0.965 . . . . 0.0 110.868 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.454 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.6 m-85 -107.28 95.72 5.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.312 0.577 . . . . 0.0 110.937 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -144.95 144.03 30.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.221 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.579 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 5.4 p-10 -88.2 142.62 31.85 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.557 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.579 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 28.5 Cg_endo -62.32 150.46 62.3 Favored 'Cis proline' 0 C--N 1.349 0.603 0 C-N-CA 123.73 -1.362 . . . . 0.0 112.343 -0.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.485 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 3.6 mp -103.14 148.39 25.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.009 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.409 ' CG2' ' HB3' ' A' ' 36' ' ' ASP . 1.9 p -78.0 146.31 8.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.598 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.1 m -79.76 172.45 13.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.19 0.519 . . . . 0.0 111.809 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -64.63 -44.4 90.62 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.841 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -34.49 77.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.185 0.517 . . . . 0.0 110.514 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.409 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 9.2 t70 -72.22 -38.18 69.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.021 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 2.0 tpt -67.81 -43.05 80.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.671 178.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.5 t -57.97 -47.27 87.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.479 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -59.59 -46.98 87.35 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.858 0.361 . . . . 0.0 110.092 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 40.6 t -58.75 -45.06 91.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.515 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.1 t -61.9 -48.57 87.96 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.383 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -58.27 -46.42 86.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.312 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.581 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -57.99 -45.6 86.53 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.076 179.175 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.45 ' CD2' HD23 ' A' ' 21' ' ' LEU . 10.9 m0 -60.21 -39.54 86.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.217 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.415 ' HG3' ' CD1' ' A' ' 74' ' ' LEU . 27.4 ttm -71.2 -43.95 66.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.784 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -73.66 -36.45 65.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.984 0.421 . . . . 0.0 110.022 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.581 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.22 -44.59 94.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.053 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -69.77 -43.67 71.7 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.944 0.402 . . . . 0.0 110.459 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.478 ' O ' ' CG ' ' A' ' 53' ' ' ARG . 9.8 mm -54.66 -55.72 14.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.452 ' HA ' ' HG3' ' A' ' 53' ' ' ARG . 11.3 t30 -62.07 -36.63 82.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.337 0.589 . . . . 0.0 110.373 179.316 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.492 ' HB2' ' O ' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -57.75 -48.53 79.36 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.332 179.72 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.45 ' O ' HG23 ' A' ' 56' ' ' VAL . 23.1 m-85 -75.63 -30.36 59.47 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.49 ' HG2' ' HG ' ' A' ' 67' ' ' LEU . 0.1 OUTLIER -62.77 -28.06 69.72 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.146 179.278 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -97.11 -15.8 20.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.02 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.463 ' HG3' ' CD1' ' A' ' 51' ' ' TYR . 12.2 mm-40 -102.71 45.19 0.97 Allowed 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.493 ' HB ' ' HD3' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -120.83 163.73 18.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.028 0.442 . . . . 0.0 111.144 179.22 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.02 171.6 14.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.565 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 81.19 -156.06 37.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.264 -0.969 . . . . 0.0 113.06 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -68.69 156.96 89.82 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.851 0.358 . . . . 0.0 111.235 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.85 -23.34 41.52 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.674 2.249 . . . . 0.0 112.9 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -65.05 -44.07 90.22 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.84 0.352 . . . . 0.0 111.461 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -64.54 -42.77 95.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.079 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.554 ' O ' HD11 ' A' ' 67' ' ' LEU . 15.8 mtt180 -53.77 -52.34 60.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -57.04 -42.18 80.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.866 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.6 -31.86 72.76 Favored 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.55 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.431 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -72.82 -40.8 65.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.493 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.554 HD11 ' O ' ' A' ' 63' ' ' ARG . 0.6 OUTLIER -70.5 -35.87 73.47 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.556 -179.59 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.405 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 15.5 pt20 -72.82 -47.62 44.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.995 0.426 . . . . 0.0 110.272 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 73' ' ' GLU . 12.3 mt-10 -61.96 -36.57 81.84 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.271 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.438 HD12 ' CD2' ' A' ' 52' ' ' TYR . 0.2 OUTLIER -64.71 -48.41 74.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.722 0.296 . . . . 0.0 110.253 179.087 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.7 ttt-85 -54.55 -43.45 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -31.78 65.09 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.448 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 4.3 tp10 -62.46 -49.48 75.27 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.128 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.434 HD21 ' CD2' ' A' ' 18' ' ' PHE . 14.0 mt -67.87 -44.7 76.45 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.053 0.454 . . . . 0.0 110.524 178.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.38 -39.65 61.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.694 -179.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.426 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 27.7 m -80.91 -50.67 9.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.737 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.415 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 1.1 mt -55.8 -33.99 64.9 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.152 -179.185 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.85 -30.93 61.51 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.3 0.481 . . . . 0.0 112.3 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.543 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 4.8 m-20 -51.72 -50.24 78.62 Favored Pre-proline 0 C--N 1.328 -0.326 0 N-CA-C 111.811 0.301 . . . . 0.0 111.811 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 51.3 Cg_endo -69.65 -36.24 11.47 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.444 2.096 . . . . 0.0 113.092 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.509 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 3.4 t80 -62.99 -53.79 48.38 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.044 0.449 . . . . 0.0 110.514 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 59.6 mt -54.96 -31.85 60.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.769 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.81 -44.78 72.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.394 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 80' ' ' PRO . 6.0 mttm -57.39 -43.33 83.55 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.077 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -74.14 -33.53 63.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.997 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -45.71 93.65 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.08 -33.0 71.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.623 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.485 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 30.5 t80 -67.42 -29.06 68.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.173 179.066 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -77.52 -44.12 29.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.613 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? -61.08 -34.32 74.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.943 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 29.1 m -60.95 -12.9 12.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.904 -178.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -63.86 175.19 1.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -120.8 158.8 26.79 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.738 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.862 0.363 . . . . 0.0 111.119 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.5 pp -113.52 -18.57 11.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.412 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.4 ttpt -51.1 -39.38 56.02 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.962 0.411 . . . . 0.0 110.743 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.19 -44.18 75.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.763 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -65.09 -43.21 92.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.307 179.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.3 tttp -65.17 -36.92 85.75 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.086 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.88 -44.51 92.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.836 0.35 . . . . 0.0 110.268 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.3 tp -61.01 -45.79 93.36 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.144 0.497 . . . . 0.0 109.837 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 11.9 mt -60.39 -53.68 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.013 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.2 p -54.31 -33.05 57.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.64 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.89 -41.45 82.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.75 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.498 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -70.24 -42.48 66.24 Favored Glycine 0 C--O 1.227 -0.316 0 N-CA-C 109.113 -1.595 . . . . 0.0 109.113 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -54.41 -58.27 8.08 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 113.822 -1.189 . . . . 0.0 109.221 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.462 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -60.38 -29.43 68.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.503 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.462 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -68.82 -46.44 68.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.437 179.616 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.565 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -71.83 -46.43 58.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.821 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 79.0 p -55.43 -51.52 66.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.02 0.438 . . . . 0.0 110.366 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.417 ' O ' ' N ' ' A' ' 24' ' ' GLN . 77.5 t -67.16 -31.11 51.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.564 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.421 HD23 ' CE3' ' A' ' 44' ' ' TRP . 18.0 tp -64.27 -46.38 83.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.895 0.379 . . . . 0.0 110.237 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 9.4 mt -66.26 -36.61 83.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.256 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.61 -17.41 44.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.386 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.417 ' N ' ' O ' ' A' ' 20' ' ' VAL . 0.4 OUTLIER -111.81 6.46 19.67 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -179.066 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.425 ' OE1' ' CE1' ' A' ' 81' ' ' PHE . 0.0 OUTLIER -48.56 162.59 0.09 Allowed 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 177.594 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 23.5 t -110.66 134.33 53.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 119.592 1.087 . . . . 0.0 110.23 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.42 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 13.4 m-85 -110.58 95.43 5.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.652 0.739 . . . . 0.0 110.916 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -124.01 151.72 43.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.361 -1.29 . . . . 0.0 111.2 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.512 ' HA ' ' N ' ' A' ' 31' ' ' LEU . 0.5 OUTLIER -100.87 145.87 31.13 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.778 179.664 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.98 115.05 3.2 Favored 'Cis proline' 0 C--N 1.35 0.623 0 C-N-CA 123.497 -1.46 . . . . 0.0 112.147 -0.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.512 ' N ' ' HA ' ' A' ' 29' ' ' ASP . 1.4 mp -44.32 146.78 0.63 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.967 -179.14 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 9.9 p -77.69 155.98 5.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.729 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.85 171.7 14.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.124 0.488 . . . . 0.0 111.725 -178.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -31.68 68.19 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.648 -179.271 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -67.07 -37.01 83.25 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.238 0.542 . . . . 0.0 110.182 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.65 -34.71 67.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.465 178.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 2.6 tpt -67.78 -46.1 72.98 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.45 178.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.8 t -55.83 -47.99 78.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.303 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.06 -46.72 84.95 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.896 0.379 . . . . 0.0 110.027 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.8 t -57.22 -47.5 84.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.577 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 32.8 t -61.37 -47.97 91.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.554 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -56.36 -48.53 76.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.505 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.569 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 1.8 m-20 -60.04 -45.07 94.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.681 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.421 ' CE3' HD23 ' A' ' 21' ' ' LEU . 13.1 m0 -60.72 -42.48 97.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.087 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 39.8 mtm -66.63 -48.74 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -178.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -70.48 -32.84 70.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.977 0.418 . . . . 0.0 110.063 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.569 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -62.75 -42.6 99.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.043 179.338 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.472 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 6.3 m-85 -69.82 -44.81 69.22 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.335 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -57.34 -55.29 21.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.937 0.399 . . . . 0.0 110.758 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -66.4 -41.19 89.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.906 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.492 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 5.0 t80 -60.43 -46.0 91.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.367 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.501 ' CD2' ' CD2' ' A' ' 70' ' ' LEU . 25.9 m-85 -70.19 -31.29 68.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.738 -0.664 . . . . 0.0 112.184 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.433 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . 34.5 ttm-85 -59.12 -27.96 66.09 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.684 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -94.99 -17.93 21.51 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.498 ' HG2' ' HA ' ' A' ' 52' ' ' TYR . 5.5 pt20 -105.54 45.13 0.98 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.51 ' HB ' ' HG3' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -124.1 163.5 23.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.525 178.792 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.4 m -127.07 166.45 17.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.441 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 91.6 -149.79 19.99 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.715 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -80.63 157.02 72.73 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.804 0.335 . . . . 0.0 111.005 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.72 -19.75 47.11 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.874 2.383 . . . . 0.0 113.479 -179.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -66.2 -43.98 85.21 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.891 0.376 . . . . 0.0 111.446 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -66.7 -35.43 80.11 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.181 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.51 ' HG3' ' HB ' ' A' ' 56' ' ' VAL . 2.2 mpt_? -59.48 -50.96 71.91 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -58.44 -41.64 85.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.548 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -49.67 73.9 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.262 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.472 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.13 -33.76 67.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.269 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.433 ' CD2' ' HB2' ' A' ' 53' ' ' ARG . 4.2 mp -69.68 -34.28 73.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.279 179.073 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.517 ' HA ' ' HG2' ' A' ' 71' ' ' ARG . 0.8 OUTLIER -74.43 -48.75 25.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.559 179.506 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.438 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 7.2 mm-40 -63.28 -30.34 71.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.875 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.501 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 1.4 tp -73.65 -48.4 32.65 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.686 -0.406 . . . . 0.0 109.945 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.517 ' HG2' ' HA ' ' A' ' 68' ' ' GLN . 6.7 ptp180 -56.88 -38.48 72.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.441 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.504 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 3.1 pt20 -75.03 -36.0 61.9 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.287 0.565 . . . . 0.0 109.51 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -62.63 -42.17 99.43 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.397 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.437 HD22 ' CD2' ' A' ' 18' ' ' PHE . 37.6 mt -67.86 -45.21 75.22 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.126 0.489 . . . . 0.0 110.009 178.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -53.78 -38.65 64.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.137 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.7 -34.53 34.54 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.059 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.419 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 3.4 mt -74.5 -28.15 60.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.046 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.08 -29.82 60.77 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.551 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.1 m120 -54.69 -50.19 87.12 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.551 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 45.1 Cg_endo -68.74 -37.04 12.75 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.403 2.069 . . . . 0.0 112.81 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.528 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 1.5 t80 -63.94 -52.61 58.96 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.087 0.47 . . . . 0.0 110.254 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 60.0 mt -57.04 -28.13 62.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.721 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.97 -46.73 61.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.905 0.383 . . . . 0.0 110.369 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.9 mmmt -57.09 -43.09 81.86 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.296 179.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -76.05 -33.32 59.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.62 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 40.8 mtt180 -64.87 -42.37 94.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.065 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.59 -34.32 67.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.268 0.556 . . . . 0.0 109.73 178.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.499 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 6.9 t80 -71.04 -28.71 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.627 179.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.2 mp -78.31 -45.47 22.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.083 179.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.401 ' HG3' ' N ' ' A' ' 91' ' ' SER . 0.0 OUTLIER -74.08 -35.38 64.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.499 -179.266 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.401 ' N ' ' HG3' ' A' ' 90' ' ' LYS . 23.2 t -79.16 -8.58 59.12 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.414 ' NE2' ' CD1' ' A' ' 31' ' ' LEU . 0.3 OUTLIER -79.39 111.97 16.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.965 0.412 . . . . 0.0 111.418 -179.746 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -121.73 122.78 40.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.49 177.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mp . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.338 -0.839 . . . . 0.0 110.895 -179.937 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.9 mm? . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 120.852 0.358 . . . . 0.0 111.414 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.9 mp 54.05 -89.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.524 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.417 ' HA ' ' HG2' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -56.66 -30.0 62.89 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.03 0.443 . . . . 0.0 110.837 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.16 -44.83 87.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.184 179.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -62.59 -53.45 54.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.462 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.417 ' HG2' ' HA ' ' A' ' 5' ' ' LYS . 1.6 pttm -61.32 -31.86 71.72 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.736 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.94 -44.57 89.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.343 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 tp -61.99 -43.79 98.1 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.6 mt -61.35 -54.36 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.463 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -55.45 -43.05 75.07 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.424 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.471 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -58.86 -43.36 90.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.851 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.667 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -69.83 -28.32 72.11 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 177.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.463 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.3 OUTLIER -65.41 -61.33 2.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.095 -1.053 . . . . 0.0 110.322 179.053 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.442 ' HG3' ' O ' ' A' ' 12' ' ' SER . 1.1 mtpt -58.0 -38.46 76.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.203 0.525 . . . . 0.0 109.932 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.6 tt0 -56.57 -49.57 74.46 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.279 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.566 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.7 OUTLIER -71.41 -50.58 30.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.553 -179.481 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -51.75 67.0 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.05 0.452 . . . . 0.0 110.776 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.451 ' O ' ' HB3' ' A' ' 24' ' ' GLN . 48.9 t -64.19 -35.64 74.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.625 179.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.444 ' HA ' ' HG3' ' A' ' 24' ' ' GLN . 0.3 OUTLIER -66.27 -45.87 79.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.688 0.28 . . . . 0.0 110.911 -179.855 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 11.1 mt -60.43 -40.26 90.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.885 0.374 . . . . 0.0 110.309 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.57 -21.93 35.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.938 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.462 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.4 OUTLIER -108.91 21.53 17.11 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.753 -179.432 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.664 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -71.07 33.24 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -179.296 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.664 ' O ' ' O ' ' A' ' 25' ' ' GLN . 21.9 t 24.86 120.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 179.045 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -110.34 95.99 5.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.023 0.439 . . . . 0.0 110.573 178.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -149.13 139.9 22.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.35 -179.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.451 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 0.5 OUTLIER -62.69 148.5 91.09 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.695 179.752 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.451 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 46.4 Cg_endo -68.3 138.35 44.47 Favored 'Cis proline' 0 C--N 1.348 0.548 0 C-N-CA 123.589 -1.421 . . . . 0.0 112.408 0.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.447 ' CD1' ' CE1' ' A' ' 92' ' ' HIS . 4.2 mt -83.86 133.65 34.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.317 -179.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.446 ' CG2' ' HB3' ' A' ' 36' ' ' ASP . 15.0 p -79.94 150.25 5.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.386 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.3 m -79.65 172.92 13.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.153 0.501 . . . . 0.0 111.632 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.4 ' O ' ' CG2' ' A' ' 38' ' ' VAL . 1.2 tm-20 -67.52 -42.62 82.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.904 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -67.92 -37.79 82.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.19 0.519 . . . . 0.0 110.599 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.446 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 9.0 t0 -67.96 -37.76 81.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.353 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.44 ' HG2' ' CD2' ' A' ' 85' ' ' TYR . 6.4 tpt -68.43 -39.9 81.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.733 178.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.4 ' CG2' ' O ' ' A' ' 34' ' ' GLU . 92.6 t -56.77 -45.71 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.682 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -46.21 91.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.937 178.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.494 ' HA ' ' OD2' ' A' ' 43' ' ' ASP . 37.0 t -55.46 -48.34 77.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.791 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.7 t -67.87 -41.35 84.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.925 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -43.68 79.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.105 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.564 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 2.8 p30 -71.54 -38.62 71.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.246 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.413 ' CZ3' HD22 ' A' ' 21' ' ' LEU . 6.6 m0 -60.98 -41.34 96.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.019 0.438 . . . . 0.0 110.474 178.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 47.8 mtm -71.01 -40.81 71.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.783 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -73.39 -35.21 65.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.028 0.442 . . . . 0.0 110.138 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.564 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -65.44 -42.0 92.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.207 179.603 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.444 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 4.5 m-85 -69.2 -44.39 72.24 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.738 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.543 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -54.39 -54.33 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.321 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.566 ' HA ' ' HG3' ' A' ' 53' ' ' ARG . 20.6 t30 -61.64 -36.75 81.7 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 121.367 0.603 . . . . 0.0 109.886 178.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.423 ' HB2' ' O ' ' A' ' 47' ' ' PHE . 1.1 t80 -59.04 -43.98 91.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.91 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.667 ' OH ' ' HA2' ' A' ' 14' ' ' GLY . 30.2 m-85 -75.36 -30.67 60.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.566 ' HG3' ' HA ' ' A' ' 50' ' ' ASN . 15.5 mtp85 -60.85 -31.26 70.71 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.63 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -93.36 -13.08 28.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.396 -178.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -107.15 39.99 1.76 Allowed 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.711 ' HB ' ' HD3' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -118.06 153.69 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.298 178.555 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.44 171.54 9.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.365 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.97 -152.93 25.13 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.954 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -73.66 161.34 79.24 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-O 120.727 0.299 . . . . 0.0 110.991 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -67.76 -25.1 40.04 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.53 2.153 . . . . 0.0 112.671 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -43.87 81.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.858 0.361 . . . . 0.0 111.138 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -66.65 -44.38 82.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.408 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.711 ' HD3' ' HB ' ' A' ' 56' ' ' VAL . 11.4 mtt85 -53.65 -51.45 63.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.14 -41.73 84.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.969 -179.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.443 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 8.5 tttp -64.22 -31.12 72.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.946 0.403 . . . . 0.0 110.86 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.85 -34.76 64.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.984 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.508 HD11 ' N ' ' A' ' 67' ' ' LEU . 3.6 mp -71.71 -36.56 70.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.361 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 6.4 pt20 -71.81 -46.49 58.01 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.402 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.0 OUTLIER -62.78 -33.82 75.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.931 178.936 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.499 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 1.5 mm? -64.3 -49.33 72.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.774 179.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.9 tpp85 -55.34 -47.43 75.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.653 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.15 -36.28 79.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.324 0.583 . . . . 0.0 109.658 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -60.96 -42.54 98.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.723 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.424 HD21 ' CE2' ' A' ' 18' ' ' PHE . 6.3 mt -67.74 -45.1 75.96 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.215 0.531 . . . . 0.0 109.954 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -52.53 -38.92 60.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.944 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.407 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 3.0 m -80.78 -50.61 9.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.79 -37.76 66.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.057 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.36 -27.84 59.31 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.543 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.7 t-20 -51.62 -50.02 79.55 Favored Pre-proline 0 CA--C 1.533 0.289 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.6 Cg_endo -69.09 -32.61 20.98 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.304 2.002 . . . . 0.0 113.082 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.502 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 10.6 t80 -64.66 -53.72 42.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.913 0.387 . . . . 0.0 110.905 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.3 mt -54.89 -37.82 66.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.185 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.36 -45.65 83.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.803 0.335 . . . . 0.0 110.591 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -58.17 -40.74 82.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.775 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.44 ' CD2' ' HG2' ' A' ' 37' ' ' MET . 0.3 OUTLIER -73.82 -33.62 64.23 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.752 179.849 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -43.45 98.81 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -72.68 -31.42 65.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.055 178.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -72.46 -29.08 63.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.905 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.42 HD22 ' CD2' ' A' ' 85' ' ' TYR . 3.0 mm? -78.44 -44.96 23.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.257 0.551 . . . . 0.0 110.067 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -75.38 -38.68 59.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.893 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.5 m -78.89 -12.62 60.04 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.447 ' CE1' ' CD1' ' A' ' 31' ' ' LEU . 4.1 t60 -59.62 107.63 0.62 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.994 0.426 . . . . 0.0 111.323 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -121.16 105.87 11.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.401 178.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.0 pp . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.947 -179.829 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.6 mp . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.862 0.363 . . . . 0.0 111.137 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 pp -161.12 28.01 0.14 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.091 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.6 -36.79 51.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.979 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.17 -46.87 87.26 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.69 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -62.86 -52.98 61.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.23 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.6 mmtp -59.41 -28.35 66.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.636 179.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.69 -45.12 68.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.499 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.2 -43.65 98.54 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 41.8 mm -64.0 -54.6 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.917 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.412 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 35.9 m -57.91 -33.24 68.55 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.745 0.307 . . . . 0.0 110.947 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.441 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -66.12 -42.92 88.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.674 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.488 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -71.14 -38.42 63.44 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 177.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.6 mm? -54.68 -59.96 4.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.018 -1.091 . . . . 0.0 109.447 178.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -33.55 71.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.027 0.441 . . . . 0.0 110.041 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.0 tp10 -61.27 -49.16 78.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.637 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.498 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -72.32 -49.09 37.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.845 -179.723 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 87.9 p -55.31 -43.57 75.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.939 0.4 . . . . 0.0 110.381 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.451 ' O ' ' CB ' ' A' ' 24' ' ' GLN . 87.6 t -74.36 -27.36 21.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.436 179.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.45 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 21.6 tp -68.9 -46.17 69.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.892 0.377 . . . . 0.0 110.305 179.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 9.3 mt -71.94 -35.14 69.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.433 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -82.71 -23.69 33.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.565 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.451 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -109.8 10.62 24.58 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.415 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.4 162.41 0.15 Allowed 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.2 t -110.3 134.98 50.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 119.645 1.111 . . . . 0.0 110.671 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 5.9 m-85 -109.6 95.54 5.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.784 0.802 . . . . 0.0 110.937 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -133.22 153.52 51.47 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.308 -1.315 . . . . 0.0 111.065 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.532 ' HA ' ' N ' ' A' ' 31' ' ' LEU . 3.4 m-20 -96.98 150.1 36.45 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.089 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -77.33 110.56 1.76 Allowed 'Cis proline' 0 C--N 1.35 0.636 0 C-N-CA 123.544 -1.44 . . . . 0.0 112.299 0.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.532 ' N ' ' HA ' ' A' ' 29' ' ' ASP . 1.2 mp -43.23 145.24 0.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.127 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 13.7 p -77.14 153.63 5.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.816 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.85 173.06 12.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.113 0.482 . . . . 0.0 111.636 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -67.75 -39.16 84.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.165 -178.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -68.09 -37.36 81.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.136 0.493 . . . . 0.0 110.701 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -70.5 -37.61 74.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.753 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.415 ' HE3' ' CZ ' ' A' ' 85' ' ' TYR . 16.2 tpp -66.99 -42.4 85.12 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.561 178.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 99.1 t -56.85 -47.94 82.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.197 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -47.52 83.62 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.176 179.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 39.1 t -55.7 -43.6 74.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.752 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.6 t -64.96 -45.47 94.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.712 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.46 -49.07 77.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.479 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.451 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -58.1 -43.26 87.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.882 179.306 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.45 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 5.3 m0 -60.64 -41.37 94.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.076 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 22.9 ttm -62.48 -50.57 70.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.053 -179.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -69.21 -35.47 76.25 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.451 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.37 -39.37 83.09 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.627 179.158 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.449 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 10.7 m-85 -72.24 -45.74 58.93 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.311 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 10.2 mm -54.07 -55.18 15.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.374 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -70.06 -35.99 74.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.906 0.384 . . . . 0.0 111.169 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.496 ' CE1' ' NE2' ' A' ' 55' ' ' GLN . 2.2 t80 -63.07 -45.8 90.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.502 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.491 ' O ' ' CG2' ' A' ' 56' ' ' VAL . 36.0 m-85 -75.5 -33.1 60.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.424 ' HD3' ' CD2' ' A' ' 67' ' ' LEU . 12.3 ttp85 -58.56 -30.98 67.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.818 0.342 . . . . 0.0 110.578 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -95.35 -11.07 28.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.889 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.496 ' NE2' ' CE1' ' A' ' 51' ' ' TYR . 1.4 mt-30 -99.86 -5.67 28.07 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -178.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.491 ' CG2' ' O ' ' A' ' 52' ' ' TYR . 0.8 OUTLIER -73.15 154.01 7.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.711 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 18.7 p -120.87 171.16 8.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.476 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.56 -147.64 23.25 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.69 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.21 164.83 54.42 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.341 . . . . 0.0 110.862 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.62 -22.53 44.01 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.616 2.211 . . . . 0.0 112.76 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.29 -44.02 80.31 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.149 0.5 . . . . 0.0 110.778 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.6 -41.53 99.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.008 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.426 ' HA ' ' CG1' ' A' ' 56' ' ' VAL . 12.0 mtt180 -56.9 -51.17 70.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.009 179.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.05 -41.71 79.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.433 -179.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.48 -49.73 76.37 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.461 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.9 -33.37 66.85 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.055 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.424 ' CD2' ' HD3' ' A' ' 53' ' ' ARG . 5.4 mp -71.18 -33.27 69.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.607 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -72.17 -49.04 38.82 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -62.24 -30.72 71.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.195 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.39 -49.14 65.13 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.37 -48.32 74.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.783 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -72.11 -31.73 66.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.99 0.424 . . . . 0.0 110.071 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -61.64 -48.3 81.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.865 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 9.2 mt -67.7 -44.68 77.15 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.048 0.451 . . . . 0.0 110.617 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.3 m-20 -52.8 -42.06 64.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.462 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.4 t -80.65 -34.19 35.09 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.436 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.426 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 2.8 mt -73.5 -30.22 62.99 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.11 -29.89 60.7 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -179.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.545 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 11.7 m-20 -57.33 -50.2 89.53 Favored Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 111.558 0.207 . . . . 0.0 111.558 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.545 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 44.9 Cg_endo -69.8 -37.59 8.86 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.36 2.04 . . . . 0.0 112.649 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.464 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 1.5 t80 -64.76 -52.57 56.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.055 0.455 . . . . 0.0 110.678 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 28.5 mt -57.1 -30.02 64.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.576 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.81 -48.04 64.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.558 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.83 -41.78 78.45 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.949 0.404 . . . . 0.0 110.266 179.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.419 ' CD2' HD22 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -74.65 -33.2 62.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.294 179.391 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -42.45 98.87 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.406 ' HA ' ' HG2' ' A' ' 90' ' ' LYS . 0.3 OUTLIER -72.64 -32.88 66.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.946 178.854 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.524 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 9.3 t80 -72.59 -28.78 63.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.049 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.419 HD22 ' CD2' ' A' ' 85' ' ' TYR . 2.2 mm? -78.32 -45.28 23.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.018 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.406 ' HG2' ' HA ' ' A' ' 87' ' ' ASP . 0.1 OUTLIER -75.46 -36.72 60.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.621 -179.288 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 53.7 m -75.52 -11.04 59.94 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.412 ' CD2' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -76.71 113.96 14.94 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.843 0.354 . . . . 0.0 111.07 -179.868 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -51.34 101.36 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.336 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.8 pp . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.243 -0.884 . . . . 0.0 111.361 -179.946 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.411 ' CD1' ' N ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 120.903 0.383 . . . . 0.0 111.325 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.1 mp -85.01 103.62 14.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.778 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -43.16 85.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.945 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.54 -45.43 91.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.847 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -63.62 -46.68 84.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.225 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.56 -30.69 71.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.603 179.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -67.26 -45.35 76.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.437 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.478 ' CD2' ' HG3' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -62.72 -42.19 99.53 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.506 -0.554 . . . . 0.0 109.506 178.73 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 25.4 mt -62.35 -54.06 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.037 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.2 t -57.47 -33.24 67.76 Favored 'General case' 0 C--N 1.333 -0.144 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 -179.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.12 -42.63 75.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.782 0.325 . . . . 0.0 110.861 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.573 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -69.91 -40.06 74.58 Favored Glycine 0 C--O 1.225 -0.459 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 177.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -54.81 -59.17 5.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.592 -1.304 . . . . 0.0 109.448 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.425 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -60.23 -30.93 69.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.543 179.685 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.425 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 0.6 OUTLIER -67.69 -46.36 72.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.241 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.586 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -69.74 -49.36 53.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.718 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 74.6 p -55.4 -50.44 69.75 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.133 0.492 . . . . 0.0 110.151 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.456 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 47.2 t -62.56 -34.55 65.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.271 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.446 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 12.2 tp -62.56 -46.22 89.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.469 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 6.0 mt -63.91 -37.24 86.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.095 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.69 -17.44 44.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.824 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 5.2 mt-30 -106.99 -3.4 20.14 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -46.9 160.09 0.09 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 19.7 t -104.69 128.41 58.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 118.81 0.732 . . . . 0.0 111.73 -179.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -102.23 121.27 41.93 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.838 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.445 ' O ' ' HA ' ' A' ' 31' ' ' LEU . 3.3 p30 -149.33 145.74 27.18 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.495 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.401 ' HA ' ' N ' ' A' ' 31' ' ' LEU . 1.7 p30 -86.75 151.37 52.46 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.294 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -77.99 17.09 8.95 Favored 'Cis proline' 0 C--N 1.347 0.489 0 C-N-CA 123.536 -1.443 . . . . 0.0 113.281 0.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.513 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 0.7 OUTLIER 72.55 144.67 0.07 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.364 0.602 . . . . 0.0 111.94 179.213 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.404 ' CG2' ' CB ' ' A' ' 36' ' ' ASP . 11.4 p -77.1 157.54 5.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.04 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.0 p -79.51 171.01 15.74 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.263 0.554 . . . . 0.0 111.909 -178.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.4 ' O ' ' CG2' ' A' ' 38' ' ' VAL . 1.5 mt-10 -68.76 -34.45 75.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.112 -178.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -34.73 78.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.9 0.381 . . . . 0.0 110.716 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.404 ' CB ' ' CG2' ' A' ' 32' ' ' VAL . 0.3 OUTLIER -71.8 -42.15 67.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.115 179.454 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.44 ' HE3' ' CE2' ' A' ' 85' ' ' TYR . 12.5 tpp -65.15 -43.43 91.83 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.4 ' CG2' ' O ' ' A' ' 34' ' ' GLU . 93.9 t -55.89 -48.0 79.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.305 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -46.62 88.23 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.864 0.364 . . . . 0.0 110.364 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 23.7 t -56.75 -45.47 82.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.835 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.5 t -66.73 -44.98 89.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.789 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -51.16 71.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.415 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.422 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.2 OUTLIER -60.05 -43.48 95.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.156 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.446 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 7.9 m0 -60.78 -41.06 94.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.337 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.9 ttp -68.0 -43.98 77.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.327 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -70.87 -39.81 72.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.941 0.401 . . . . 0.0 110.014 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.445 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -59.38 -41.5 89.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.574 179.091 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.453 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 3.9 m-85 -65.01 -48.09 75.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.775 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -54.2 -55.0 16.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.082 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -68.97 -36.74 78.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.806 0.336 . . . . 0.0 111.085 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.445 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 7.0 t80 -63.07 -42.04 99.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.126 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.573 ' OH ' ' HA2' ' A' ' 14' ' ' GLY . 27.8 m-85 -75.47 -33.68 60.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.54 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.411 ' HA ' HD13 ' A' ' 67' ' ' LEU . 2.8 ttm-85 -58.37 -31.59 67.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.12 0.486 . . . . 0.0 110.581 179.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -101.03 -9.81 21.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.196 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.478 ' HG3' ' CD2' ' A' ' 10' ' ' LEU . 12.4 tp-100 -97.54 -3.29 40.04 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.652 ' HB ' ' CG ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -78.81 173.58 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.469 179.564 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.0 m -139.79 171.09 14.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.034 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 88.15 -150.4 22.07 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.171 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.9 162.95 65.67 Favored Pre-proline 0 C--N 1.334 -0.103 0 CA-C-O 120.829 0.347 . . . . 0.0 111.286 -179.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.26 -26.62 41.71 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.914 2.409 . . . . 0.0 113.319 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -70.82 -44.18 67.05 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.067 0.461 . . . . 0.0 110.891 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -67.38 -38.25 84.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.959 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.652 ' CG ' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -57.64 -51.3 70.07 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.39 0.614 . . . . 0.0 109.427 178.896 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -58.06 -41.64 83.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.649 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -61.59 -49.69 75.62 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.474 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.1 -33.66 67.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.22 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' A' ' 53' ' ' ARG . 5.5 mp -69.99 -36.55 75.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.32 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -72.89 -44.74 60.92 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.218 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -63.03 -38.59 91.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.351 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.447 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -63.39 -49.11 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.792 179.521 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -55.19 -44.85 75.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.523 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.26 -34.52 76.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.24 0.543 . . . . 0.0 109.846 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -60.88 -45.3 95.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.068 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.9 mt -67.61 -45.08 76.46 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.972 0.415 . . . . 0.0 110.366 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -39.8 63.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.011 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.3 t -80.55 -36.15 33.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.041 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.445 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 2.4 mt -71.24 -29.88 65.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.898 -179.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.84 -30.08 63.73 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.552 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.5 t30 -57.73 -50.09 90.06 Favored Pre-proline 0 CA--C 1.532 0.28 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 40.5 Cg_endo -67.69 -42.01 7.44 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.278 1.985 . . . . 0.0 112.828 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.438 ' HB2' ' CD1' ' A' ' 22' ' ' LEU . 1.8 t80 -63.76 -52.59 59.72 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.155 0.502 . . . . 0.0 110.036 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.403 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 24.1 mt -56.59 -29.28 61.9 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.429 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.433 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.03 -48.33 63.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.847 0.356 . . . . 0.0 110.519 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.2 mmtm -57.17 -40.78 77.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.551 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.44 ' CE2' ' HE3' ' A' ' 37' ' ' MET . 0.2 OUTLIER -77.61 -33.15 53.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.721 -179.544 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.433 ' HG2' ' HA ' ' A' ' 83' ' ' ALA . 1.0 OUTLIER -68.33 -40.52 81.57 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.016 179.409 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.59 -37.21 68.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.862 179.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.513 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 9.1 t80 -71.92 -29.22 64.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.14 178.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.64 -45.52 21.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.422 178.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -67.24 -32.3 73.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.8 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 75.1 m -77.64 -2.42 35.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.514 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.463 ' CE1' ' CD1' ' A' ' 31' ' ' LEU . 46.0 m170 -83.69 105.2 14.41 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.861 0.362 . . . . 0.0 110.945 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.67 103.04 0.06 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.051 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 25.5 mt . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.93 -179.99 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 28.1 mt . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.668 0.27 . . . . 0.0 111.296 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.404 ' N ' ' CD1' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -54.02 -48.55 70.37 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.827 0.346 . . . . 0.0 111.058 -179.962 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -22.37 32.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.688 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -63.88 -44.2 93.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.52 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -63.59 -57.64 9.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.977 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -57.57 -34.21 68.98 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.852 179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -62.32 -44.12 97.23 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.443 . . . . 0.0 109.831 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.414 HD11 ' CD2' ' A' ' 52' ' ' TYR . 0.3 OUTLIER -60.63 -43.32 97.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.716 178.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 40.5 mm -62.04 -54.58 32.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.01 -32.91 22.77 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.668 0.271 . . . . 0.0 111.222 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.13 -42.06 69.7 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.596 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.554 ' N ' ' OH ' ' A' ' 52' ' ' TYR . . . -71.07 -28.42 70.39 Favored Glycine 0 C--O 1.231 -0.085 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 177.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -70.52 -61.17 1.87 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.511 -0.845 . . . . 0.0 109.092 178.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.427 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -57.21 -30.9 64.94 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.896 -179.954 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.427 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 1.5 mm-40 -68.24 -46.09 71.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.413 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.558 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -73.82 -47.38 39.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.351 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.52 -51.42 67.07 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.953 0.406 . . . . 0.0 110.484 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.482 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 58.0 t -66.41 -36.77 78.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.642 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.469 ' CD1' ' CZ2' ' A' ' 44' ' ' TRP . 0.8 OUTLIER -59.52 -46.18 89.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.76 0.314 . . . . 0.0 111.137 -179.818 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 15.0 mt -70.51 -34.92 72.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.987 0.422 . . . . 0.0 110.396 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -82.7 -18.43 40.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.154 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.482 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 2.1 mp0 -117.44 12.37 14.18 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -51.58 162.92 0.33 Allowed 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 177.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 24.2 t -112.57 136.41 48.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 119.854 1.206 . . . . 0.0 110.876 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.478 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.2 m-85 -112.15 95.26 5.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.776 0.798 . . . . 0.0 110.545 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -137.84 157.46 46.38 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.311 -1.313 . . . . 0.0 111.002 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.642 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 1.2 p30 -101.33 147.0 33.18 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.774 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.642 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 19.7 Cg_endo -58.08 142.61 23.76 Favored 'Cis proline' 0 C--N 1.351 0.704 0 C-N-CA 123.857 -1.31 . . . . 0.0 112.53 -0.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.466 HD23 ' CE2' ' A' ' 88' ' ' PHE . 7.6 mt -82.19 132.12 35.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.058 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.485 ' CG2' ' HB3' ' A' ' 36' ' ' ASP . 14.9 p -74.83 143.91 12.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.829 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.7 p -79.97 172.79 13.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.957 0.408 . . . . 0.0 111.537 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.405 ' O ' ' CG2' ' A' ' 38' ' ' VAL . 0.0 OUTLIER -71.07 -29.66 65.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.423 -179.515 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.44 -38.27 81.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.223 0.535 . . . . 0.0 110.267 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.485 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 4.9 t70 -71.83 -36.92 70.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.501 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.402 ' HE3' ' CZ ' ' A' ' 85' ' ' TYR . 1.8 tpt -67.05 -45.71 76.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.482 178.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.405 ' CG2' ' O ' ' A' ' 34' ' ' GLU . 89.7 t -55.78 -46.54 79.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.302 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -46.3 88.94 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.847 0.356 . . . . 0.0 110.16 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.0 t -58.41 -44.05 87.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.696 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 24.9 t -65.48 -48.47 82.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.611 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.58 -46.52 77.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.464 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.605 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -64.53 -40.89 96.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.542 179.56 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.469 ' CZ2' ' CD1' ' A' ' 21' ' ' LEU . 5.8 m0 -60.83 -43.99 97.53 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.948 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.7 mtm -66.96 -48.91 67.1 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.781 -178.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -71.13 -28.1 64.04 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.605 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.76 -48.13 82.07 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.125 179.262 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -71.69 -38.48 70.59 Favored 'General case' 0 C--O 1.227 -0.09 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.114 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.414 ' CD1' ' HB2' ' A' ' 71' ' ' ARG . 10.8 mm -57.41 -55.34 21.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.799 0.333 . . . . 0.0 111.274 -179.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -67.33 -39.71 85.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.186 0.517 . . . . 0.0 110.386 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.485 ' CE1' ' HG3' ' A' ' 55' ' ' GLN . 0.5 OUTLIER -61.07 -38.2 85.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.485 179.599 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.554 ' OH ' ' N ' ' A' ' 14' ' ' GLY . 3.2 m-85 -76.1 -36.74 58.79 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -178.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.6 ttm180 -59.96 -26.53 66.07 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.419 -179.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 54' ' ' GLN . 6.9 tt0 -93.79 -13.51 27.26 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.485 ' HG3' ' CE1' ' A' ' 51' ' ' TYR . 18.7 mm-40 -103.09 1.94 34.03 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -178.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.506 ' HB ' ' HB3' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -85.85 168.96 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.288 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.1 p -142.58 171.34 14.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.837 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 87.39 -153.54 25.31 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.373 -0.918 . . . . 0.0 112.774 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.5 144.34 86.31 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-O 120.683 0.277 . . . . 0.0 110.891 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.445 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 19.1 Cg_endo -59.12 -24.6 74.47 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.79 2.327 . . . . 0.0 112.725 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.07 -38.32 75.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.938 0.399 . . . . 0.0 110.673 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -68.65 -47.0 67.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.284 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.506 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -63.51 -50.7 68.58 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.114 0.483 . . . . 0.0 110.066 179.743 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.39 -37.36 67.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.085 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.69 -50.14 59.19 Favored 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.467 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.57 -35.0 73.43 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.22 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.448 ' N ' HD22 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -69.44 -40.49 77.17 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.116 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -72.08 -41.62 67.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.079 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.489 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 7.9 mt-10 -66.78 -37.67 85.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.402 ' CD2' ' HA ' ' A' ' 67' ' ' LEU . 0.4 OUTLIER -67.04 -44.48 80.11 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.282 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.414 ' HB2' ' CD1' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -55.21 -49.01 73.05 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.828 179.509 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.489 ' HG2' ' HA ' ' A' ' 69' ' ' GLU . 8.4 pt20 -63.31 -31.83 73.09 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -63.83 -42.45 97.63 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.719 179.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.426 HD21 ' CD2' ' A' ' 18' ' ' PHE . 5.2 mt -68.02 -45.38 74.18 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 121.134 0.492 . . . . 0.0 110.062 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.76 -37.14 65.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.004 -179.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 11.0 t -80.86 -32.8 34.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.704 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.418 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 1.5 mt -75.07 -29.64 60.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.895 -179.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.17 -32.1 61.18 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.536 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 3.1 m120 -52.12 -50.2 80.22 Favored Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 49.0 Cg_endo -69.92 -34.98 13.0 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.353 2.036 . . . . 0.0 112.76 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.489 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 1.8 t80 -65.31 -53.67 40.49 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.1 mt -58.81 -28.08 65.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.449 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.467 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.71 -41.3 75.55 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.105 0.479 . . . . 0.0 110.376 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -42.52 92.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.587 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.402 ' CZ ' ' HE3' ' A' ' 37' ' ' MET . 0.4 OUTLIER -74.62 -37.92 62.7 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.927 -179.38 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.467 ' HG2' ' HA ' ' A' ' 83' ' ' ALA . 12.1 ptm180 -65.32 -37.31 86.73 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.5 -34.91 67.99 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.466 ' CE2' HD23 ' A' ' 31' ' ' LEU . 45.6 t80 -72.05 -28.29 63.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.765 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.449 ' HA ' ' CE1' ' A' ' 92' ' ' HIS . 1.1 mm? -75.05 -45.8 39.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.408 179.142 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -75.93 -34.49 59.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.624 -179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 66.6 m -82.47 -17.0 46.76 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.531 ' O ' ' CD2' ' A' ' 92' ' ' HIS . 0.7 OUTLIER -89.77 126.09 35.54 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.023 179.136 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -51.67 86.68 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.425 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.439 ' N ' ' O ' ' A' ' 92' ' ' HIS . 3.4 mt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.954 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.803 0.335 . . . . 0.0 111.087 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.5 mt -143.0 101.11 3.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.073 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -22.71 57.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.701 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -63.38 -46.77 84.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.958 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -63.27 -53.24 55.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.452 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.6 tttm -62.5 -30.9 71.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.988 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -67.78 -40.38 83.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.842 0.353 . . . . 0.0 110.347 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.5 tp -65.22 -44.28 88.82 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.8 mt -61.95 -54.5 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.493 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 23.1 t -55.61 -39.74 71.16 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.21 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.11 -40.11 80.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.23 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.473 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -70.66 -30.86 68.13 Favored Glycine 0 N--CA 1.451 -0.308 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.7 mm? -64.9 -61.33 2.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.102 -1.049 . . . . 0.0 110.608 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.3 mttm -62.17 -36.59 82.33 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -59.72 -50.67 72.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.97 178.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.496 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 1.0 OUTLIER -67.26 -50.54 60.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.101 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 t -57.81 -51.63 68.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.874 0.369 . . . . 0.0 111.089 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.9 t -64.75 -32.57 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.769 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.488 ' O ' ' N ' ' A' ' 25' ' ' GLN . 0.2 OUTLIER -70.36 -46.26 64.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.103 179.73 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.499 HD21 ' CD2' ' A' ' 81' ' ' PHE . 13.8 mt -62.1 -37.58 85.62 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.441 -179.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.63 -38.79 23.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.727 0.298 . . . . 0.0 111.603 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.732 ' O ' ' N ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -106.46 21.31 17.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.776 -179.208 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.488 ' N ' ' O ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -46.27 60.96 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.416 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.732 ' N ' ' O ' ' A' ' 24' ' ' GLN . 11.6 p 27.96 102.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 123.42 0.688 . . . . 0.0 112.517 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.52 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 14.2 m-30 -108.21 95.86 5.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.515 0.674 . . . . 0.0 111.185 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 66.4 m-20 -137.03 149.12 47.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.786 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.522 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 4.5 p-10 -95.95 136.79 21.97 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.426 179.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.522 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 32.4 Cg_endo -63.82 156.74 71.08 Favored 'Cis proline' 0 C--N 1.35 0.625 0 C-N-CA 123.825 -1.323 . . . . 0.0 112.415 0.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.467 HD13 ' CE1' ' A' ' 92' ' ' HIS . 7.1 mt -102.0 147.09 26.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.363 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.2 p -76.7 148.59 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.9 m -79.22 169.69 17.75 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.164 0.506 . . . . 0.0 111.535 -177.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.53 -36.61 81.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.03 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -36.53 84.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.152 0.501 . . . . 0.0 110.353 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.2 -37.62 63.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.337 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.441 ' HE3' ' CE1' ' A' ' 85' ' ' TYR . 0.2 OUTLIER -64.35 -47.23 80.14 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.716 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.2 t -57.61 -45.48 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.803 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.0 m -57.96 -47.9 81.55 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.822 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.415 HG13 ' CE3' ' A' ' 44' ' ' TRP . 40.8 t -57.65 -40.24 74.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.808 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 5.1 t -63.02 -48.05 89.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.528 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.484 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 0.3 OUTLIER -54.77 -45.58 74.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.735 179.726 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.537 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -72.15 -36.38 69.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.746 179.648 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.422 ' CH2' HD13 ' A' ' 21' ' ' LEU . 1.9 m0 -64.46 -45.33 87.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.321 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.484 ' SD ' ' HA ' ' A' ' 42' ' ' GLU . 1.9 ptm -71.5 -36.14 71.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.495 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -71.94 -40.81 68.47 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.537 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.5 -46.19 91.04 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.793 179.099 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.474 ' CD1' ' CZ ' ' A' ' 52' ' ' TYR . 3.4 m-85 -60.3 -47.67 85.04 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.644 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.4 mm -54.19 -55.34 14.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.357 -179.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.499 ' HA ' ' HG2' ' A' ' 53' ' ' ARG . 43.9 t30 -69.8 -33.39 72.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.029 0.442 . . . . 0.0 111.171 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.481 ' CZ ' ' NE2' ' A' ' 55' ' ' GLN . 17.0 t80 -68.19 -40.95 82.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.782 -179.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.474 ' CZ ' ' CD1' ' A' ' 48' ' ' TYR . 21.9 m-85 -75.68 -36.56 60.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.348 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.499 ' HG2' ' HA ' ' A' ' 50' ' ' ASN . 7.1 ptp85 -59.88 -24.64 64.43 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.498 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -92.52 -23.64 19.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.519 -179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.481 ' NE2' ' CZ ' ' A' ' 51' ' ' TYR . 29.0 mt-30 -93.71 34.21 1.22 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.036 0.446 . . . . 0.0 111.666 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.484 ' CG1' ' HG3' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -112.97 164.76 8.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.093 -179.665 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.6 m -138.45 171.74 13.92 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 81.56 -163.4 44.35 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 119.869 -1.158 . . . . 0.0 112.866 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -64.55 160.55 51.29 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-O 120.872 0.368 . . . . 0.0 111.36 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.62 -26.96 39.17 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.92 2.413 . . . . 0.0 112.984 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.62 -41.4 73.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.183 0.516 . . . . 0.0 111.287 -179.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -63.37 -46.66 85.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.029 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.484 ' HG3' ' CG1' ' A' ' 56' ' ' VAL . 2.3 mpt_? -56.09 -51.63 67.19 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.166 0.508 . . . . 0.0 110.26 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.409 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 0.1 OUTLIER -55.58 -41.6 73.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.256 -178.901 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -49.72 76.45 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.98 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.411 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.2 -36.93 71.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.946 -179.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mp -70.47 -33.26 71.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.8 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.409 ' CG ' ' O ' ' A' ' 64' ' ' ASP . 1.2 mt-30 -73.55 -48.54 32.17 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.941 0.401 . . . . 0.0 110.192 179.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.27 -33.19 74.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.423 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.502 ' O ' HD21 ' A' ' 74' ' ' LEU . 0.8 OUTLIER -69.39 -48.27 61.64 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.749 -0.38 . . . . 0.0 109.978 179.195 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -55.23 -40.83 71.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.926 0.393 . . . . 0.0 110.392 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.0 -46.41 43.85 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.408 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.492 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 34.2 mm-40 -60.61 -34.1 73.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.033 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.502 HD21 ' O ' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -68.86 -47.02 66.99 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.284 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -53.72 -37.23 63.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.877 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.543 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 1.0 OUTLIER -81.14 -50.74 9.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.048 179.546 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.492 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 3.9 mt -60.18 -39.54 86.85 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 -178.403 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.24 -46.95 81.55 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -177.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.487 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.5 OUTLIER -50.98 -50.48 74.6 Favored Pre-proline 0 CA--C 1.535 0.393 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.264 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.543 ' CD ' ' O ' ' A' ' 76' ' ' THR . 50.5 Cg_endo -69.86 -24.09 29.59 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 122.313 2.009 . . . . 0.0 112.946 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.499 ' CD2' HD21 ' A' ' 22' ' ' LEU . 1.3 t80 -67.84 -53.48 26.55 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.769 0.319 . . . . 0.0 110.89 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.12 -29.31 60.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.523 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.12 -47.51 57.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.39 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.2 mmmm -56.98 -38.99 73.8 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.496 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.441 ' CE1' ' HE3' ' A' ' 37' ' ' MET . 0.6 OUTLIER -73.85 -33.89 64.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.54 179.779 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -42.47 99.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.133 0.492 . . . . 0.0 109.757 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.88 -32.4 65.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.181 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.52 ' CE2' ' CD2' ' A' ' 27' ' ' PHE . 22.0 t80 -73.55 -28.72 62.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.956 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.8 mt -76.59 -44.82 32.84 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.56 -34.41 75.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.957 -1.019 . . . . 0.0 111.45 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 77.5 p -101.37 0.58 37.28 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -178.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.489 ' HB2' ' O ' ' A' ' 88' ' ' PHE . 24.2 t60 -51.46 114.53 1.26 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.637 0.732 . . . . 0.0 111.919 -177.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -51.1 159.14 0.65 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 114.494 -1.23 . . . . 0.0 112.969 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.6 pp . . . . . 0 C--O 1.248 1.01 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.118 179.674 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 tp . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.714 0.292 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -146.91 93.37 2.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.919 0.39 . . . . 0.0 111.264 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.403 ' O ' ' HB3' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -58.66 -20.72 50.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.923 179.393 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.62 -45.69 73.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.191 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -62.4 -54.87 33.92 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.123 0.487 . . . . 0.0 110.356 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt -60.03 -29.3 68.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.048 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.403 ' HB3' ' O ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -70.26 -39.23 75.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.704 -0.226 . . . . 0.0 110.396 -179.946 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.67 -44.77 85.24 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 179.062 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 42.4 mm -62.06 -54.45 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.05 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.7 t -61.42 -34.29 75.13 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 120.815 0.34 . . . . 0.0 110.276 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.11 -40.33 85.04 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.933 -179.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.481 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -68.96 -43.64 72.16 Favored Glycine 0 N--CA 1.454 -0.154 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 177.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -54.27 -58.62 6.69 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.081 -1.06 . . . . 0.0 109.613 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.44 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -60.84 -29.36 69.46 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.038 178.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.44 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 5.5 mt-10 -65.27 -48.9 71.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.977 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.494 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -65.49 -50.14 66.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.654 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -51.65 68.59 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.066 0.46 . . . . 0.0 110.787 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.404 ' CG2' ' O ' ' A' ' 16' ' ' LYS . 70.6 t -62.34 -28.26 44.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.477 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.452 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 1.5 tp -66.71 -46.45 75.51 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 2.1 mt -62.42 -38.1 88.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.776 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -24.88 34.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.31 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.483 ' C ' ' H ' ' A' ' 26' ' ' VAL . 3.1 tt0 -113.11 21.16 15.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.7 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.588 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -70.25 34.59 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.295 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.588 ' O ' ' O ' ' A' ' 25' ' ' GLN . 16.5 t 31.93 115.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 178.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 88' ' ' PHE . 2.7 m-85 -107.23 128.37 54.36 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.741 0.781 . . . . 0.0 110.682 178.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.773 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 9.2 p-10 -149.45 152.77 36.22 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.837 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.501 ' HB3' ' CE1' ' A' ' 92' ' ' HIS . 3.0 p30 -131.53 117.24 16.48 Favored Pre-proline 0 C--N 1.314 -0.966 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.998 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.72 172.96 56.57 Favored 'Cis proline' 0 C--N 1.348 0.542 0 C-N-CA 123.457 -1.476 . . . . 0.0 112.386 0.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.773 ' HB3' ' O ' ' A' ' 28' ' ' ASN . 2.7 pt? -157.71 -156.0 0.55 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.452 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.437 ' N ' ' HG ' ' A' ' 31' ' ' LEU . 13.7 p -74.49 138.92 20.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.411 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.8 p -80.31 175.37 10.71 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.016 0.436 . . . . 0.0 111.574 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.76 -38.89 87.51 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.117 -179.152 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.68 -36.07 82.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.287 0.565 . . . . 0.0 110.303 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -74.03 -34.81 64.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.427 178.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.452 ' HE2' ' CZ ' ' A' ' 81' ' ' PHE . 19.7 tpp -67.46 -47.31 70.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.629 178.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 49.0 t -56.64 -47.66 81.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.423 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -58.07 -46.06 86.07 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.42 HG11 ' CD2' ' A' ' 44' ' ' TRP . 48.2 t -59.13 -37.67 69.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.78 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.7 t -65.44 -49.13 80.17 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.781 0.324 . . . . 0.0 110.78 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.447 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 1.3 tt0 -55.37 -46.55 76.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.105 0.479 . . . . 0.0 110.777 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.603 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -71.74 -36.32 70.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.996 179.613 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.452 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 4.1 m0 -65.03 -45.82 83.87 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.523 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.533 ' HA ' HD13 ' A' ' 74' ' ' LEU . 1.6 ptm -71.41 -37.49 71.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.527 -179.399 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -71.34 -39.28 71.44 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.603 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.05 -45.88 92.97 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.058 179.194 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -61.64 -47.99 82.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.199 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -54.48 -55.28 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.217 -179.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 30.0 t30 -69.46 -37.3 77.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.008 0.432 . . . . 0.0 111.09 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.461 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 21.2 t80 -61.26 -43.8 98.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.864 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.524 ' O ' HG21 ' A' ' 56' ' ' VAL . 23.5 m-85 -75.51 -29.29 59.46 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.244 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.416 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . 10.4 ttm180 -57.55 -27.55 62.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.949 0.404 . . . . 0.0 110.172 178.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -101.81 -15.4 16.93 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -97.53 46.21 1.03 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.821 0.343 . . . . 0.0 111.63 -179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.524 HG21 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -125.3 164.62 24.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.299 -179.616 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 18.7 p -134.46 171.47 14.26 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 79.23 -149.95 33.03 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.016 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.98 156.12 92.46 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.822 0.344 . . . . 0.0 111.273 -179.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.45 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 42.8 Cg_endo -67.67 -25.94 39.79 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.73 2.287 . . . . 0.0 112.681 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.12 -41.68 93.16 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.894 0.378 . . . . 0.0 111.359 -179.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -61.1 -46.78 89.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.498 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.509 ' CD ' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.48 -50.81 68.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.207 0.527 . . . . 0.0 109.684 179.471 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -55.26 -41.4 72.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.693 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.439 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 14.5 ttmt -63.05 -49.91 72.7 Favored 'General case' 0 C--N 1.334 -0.104 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.656 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.23 -34.46 68.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.848 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.416 ' CD2' ' HB2' ' A' ' 53' ' ' ARG . 7.4 mp -71.81 -39.53 69.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.825 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.439 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 7.2 pt20 -73.2 -47.0 47.21 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.813 0.34 . . . . 0.0 110.403 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.461 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -62.32 -39.72 93.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.127 179.614 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.482 ' O ' HD21 ' A' ' 74' ' ' LEU . 7.0 mt -61.84 -48.89 78.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.197 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -55.45 -44.68 76.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.813 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.568 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -70.53 -38.26 74.21 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.142 0.496 . . . . 0.0 110.342 179.469 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.568 ' N ' ' HG3' ' A' ' 72' ' ' GLN . 1.7 tp10 -65.21 -32.78 74.62 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.24 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.6 ' N ' HD21 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -68.44 -45.91 71.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.515 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -53.7 -39.71 65.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.988 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.481 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 7.3 t -80.74 -50.58 9.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.85 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.9 mt -58.07 -35.14 70.94 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -179.116 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.44 -38.37 71.33 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.516 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 3.6 m120 -51.75 -50.28 78.51 Favored Pre-proline 0 C--N 1.328 -0.359 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 55.2 Cg_endo -70.08 -28.67 23.42 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.49 2.127 . . . . 0.0 113.18 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.455 ' CE2' HD21 ' A' ' 22' ' ' LEU . 2.3 t80 -65.51 -52.45 52.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.89 0.376 . . . . 0.0 111.4 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 55.0 mt -58.94 -28.64 66.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.841 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.25 -48.0 53.67 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.758 0.313 . . . . 0.0 110.434 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -56.93 -40.5 76.49 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.094 0.473 . . . . 0.0 110.115 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.44 ' CG ' ' HE1' ' A' ' 37' ' ' MET . 0.1 OUTLIER -70.95 -33.35 70.39 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.29 179.447 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 52.2 mmt-85 -61.52 -41.03 96.71 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.494 ' HA ' ' HG2' ' A' ' 90' ' ' LYS . 1.1 m-20 -72.71 -31.11 64.76 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.352 178.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.507 ' CZ ' ' NE2' ' A' ' 92' ' ' HIS . 43.9 t80 -75.96 -28.75 58.03 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.213 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -78.09 -45.28 23.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.564 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.494 ' HG2' ' HA ' ' A' ' 87' ' ' ASP . 15.2 ptpt -70.15 -34.12 72.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.08 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 87.3 p -78.96 -26.9 43.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.209 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.507 ' NE2' ' CZ ' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -63.29 110.67 1.97 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.895 0.379 . . . . 0.0 111.095 -179.781 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -52.64 91.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.231 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.8 mt . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.911 179.955 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.711 0.291 . . . . 0.0 111.147 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 mp -85.51 7.57 22.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.47 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.98 -27.62 14.0 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.323 0.582 . . . . 0.0 109.884 178.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.05 -44.42 74.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.786 178.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -61.94 -55.79 25.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.262 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.84 -31.72 66.93 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.038 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.4 -43.78 84.85 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.566 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.438 HD22 ' CD1' ' A' ' 52' ' ' TYR . 0.5 OUTLIER -60.25 -46.36 90.07 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.801 179.046 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.8 mt -60.66 -54.36 36.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.472 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 0.1 OUTLIER -53.92 -38.6 65.04 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 120.921 0.391 . . . . 0.0 110.435 179.57 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -58.49 -43.65 89.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.979 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.465 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -66.81 -28.05 73.6 Favored Glycine 0 N--CA 1.452 -0.239 0 N-CA-C 110.076 -1.21 . . . . 0.0 110.076 176.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.451 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.1 OUTLIER -68.58 -61.48 1.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.475 -0.862 . . . . 0.0 110.617 179.397 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 12' ' ' SER . 2.6 mmtp -56.78 -35.38 68.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.143 0.497 . . . . 0.0 110.11 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.1 tt0 -59.87 -50.72 72.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.663 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.444 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -73.59 -44.74 56.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.472 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.11 -51.67 68.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.89 0.376 . . . . 0.0 110.774 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 47.6 t -66.91 -33.49 63.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.676 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.488 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 1.1 tp -68.44 -45.69 71.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.862 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.538 HD21 ' CD2' ' A' ' 81' ' ' PHE . 2.8 mt -63.15 -42.85 99.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.83 0.347 . . . . 0.0 110.814 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -82.8 -23.78 33.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.82 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.512 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -117.58 21.53 12.94 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -178.727 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.476 ' O ' ' C ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -67.05 42.23 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.321 0.105 . . . . 0.0 111.247 179.891 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.512 ' H ' ' C ' ' A' ' 24' ' ' GLN . 16.8 t -6.79 124.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.112 0.965 . . . . 0.0 113.558 -179.691 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.427 ' CE1' ' OE1' ' A' ' 25' ' ' GLN . 17.9 m-85 -79.19 96.5 5.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.722 179.072 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.44 ' O ' ' O ' ' A' ' 30' ' ' PRO . 12.7 p-10 -85.22 136.83 33.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.196 -178.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.591 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 2.1 p-10 -99.71 135.15 20.62 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.223 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.591 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 19.3 Cg_endo -58.43 152.09 38.16 Favored 'Cis proline' 0 C--N 1.353 0.776 0 C-N-CA 124.153 -1.186 . . . . 0.0 112.621 0.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.0 mt -86.75 140.66 29.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.416 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 12.8 p -88.31 153.4 3.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.178 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.9 p -79.67 175.53 10.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.102 0.477 . . . . 0.0 111.806 -178.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -70.3 -41.14 73.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.852 -178.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.34 -36.55 84.49 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.19 0.519 . . . . 0.0 110.496 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -73.49 -35.82 65.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.612 178.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 2.7 tpt -66.87 -43.12 84.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.503 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 50.5 t -59.48 -45.68 93.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.264 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -47.14 84.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.114 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 22.9 t -58.6 -43.45 87.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.563 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 26.1 t -59.2 -48.83 85.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.589 179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.55 -42.03 77.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.582 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.45 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -58.18 -46.44 85.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.149 179.368 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.488 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 28.8 m0 -60.69 -40.63 92.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.969 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 31.5 ttm -64.2 -50.89 66.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.769 -0.65 . . . . 0.0 112.379 -178.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -70.24 -29.31 66.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.002 0.43 . . . . 0.0 110.18 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.45 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.81 -42.33 97.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.122 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.434 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 27.0 m-85 -73.06 -41.74 63.83 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.527 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.9 mm -55.7 -55.4 17.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.499 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -69.48 -38.37 77.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.965 0.412 . . . . 0.0 110.968 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.413 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.7 t80 -59.89 -46.2 90.09 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.212 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.465 ' OH ' ' HA2' ' A' ' 14' ' ' GLY . 23.0 m-85 -75.84 -28.93 58.42 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.436 ' HG3' HD23 ' A' ' 67' ' ' LEU . 11.4 ttm180 -65.22 -28.66 69.52 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.746 -0.381 . . . . 0.0 110.757 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -91.49 -21.78 20.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.092 -178.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -94.17 46.1 1.15 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.42 ' CG1' ' HG3' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -132.19 -176.13 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.237 0.541 . . . . 0.0 112.0 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.985 ' O ' ' N ' ' A' ' 59' ' ' GLU . 1.5 p -128.49 163.67 24.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.399 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -32.81 50.4 0.0 OUTLIER Glycine 0 N--CA 1.473 1.134 0 N-CA-C 115.003 0.761 . . . . 0.0 115.003 -178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.985 ' N ' ' O ' ' A' ' 57' ' ' THR . 2.2 mm-40 -110.57 65.11 0.44 Allowed Pre-proline 0 N--CA 1.432 -1.346 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 176.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -51.42 -43.37 50.15 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 121.173 1.248 . . . . 0.0 111.015 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -71.02 -36.3 72.36 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.621 178.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.612 ' HB3' ' HB3' ' A' ' 59' ' ' GLU . 0.1 OUTLIER -79.63 -35.05 40.03 Favored 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 119.781 -0.768 . . . . 0.0 111.996 -179.68 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.422 ' O ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -65.84 -52.5 49.92 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 179.758 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.29 -41.55 84.65 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.976 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.44 -45.79 71.58 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 119.946 -0.702 . . . . 0.0 110.077 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.95 -39.72 75.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.116 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.436 HD23 ' HG3' ' A' ' 53' ' ' ARG . 7.2 mp -69.82 -35.33 74.7 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.024 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.421 ' O ' ' HG2' ' A' ' 71' ' ' ARG . 3.9 mm-40 -70.42 -46.97 62.89 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.192 0.52 . . . . 0.0 109.728 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.1 -27.24 67.91 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.178 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.36 -50.17 23.38 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.421 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 13.9 ptm180 -57.63 -41.56 81.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.304 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -31.36 61.09 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -61.59 -46.77 88.43 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.256 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.2 mt -67.92 -42.83 80.47 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-O 121.051 0.453 . . . . 0.0 110.182 178.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -52.47 -42.08 63.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.177 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.1 t -81.13 -29.69 34.71 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.815 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.44 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 5.9 mt -79.37 -37.86 36.34 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.71 -29.89 59.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.626 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.55 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -51.07 -50.3 76.06 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.885 -178.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.55 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 45.7 Cg_endo -69.4 -31.02 22.98 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.061 1.841 . . . . 0.0 112.39 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.538 ' CD2' HD21 ' A' ' 22' ' ' LEU . 1.1 t80 -69.85 -54.59 12.84 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.7 mt -55.77 -34.45 65.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.146 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.609 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . . . -62.43 -48.28 80.37 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.299 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -44.7 88.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.966 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -71.32 -41.01 70.4 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.609 ' HG2' ' HA ' ' A' ' 83' ' ' ALA . 0.4 OUTLIER -62.75 -36.73 83.97 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.175 -179.71 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.438 ' N ' ' HG3' ' A' ' 86' ' ' ARG . 0.5 OUTLIER -72.82 -36.4 67.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.197 0.522 . . . . 0.0 109.93 178.645 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.476 ' CZ ' ' CE1' ' A' ' 92' ' ' HIS . 18.5 t80 -70.5 -32.86 70.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.687 179.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -78.5 -45.2 22.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.42 0.629 . . . . 0.0 109.622 178.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -31.52 69.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.864 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 85.0 p -96.0 -18.01 20.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.573 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.476 ' CE1' ' CZ ' ' A' ' 88' ' ' PHE . 1.6 t60 -56.0 104.86 0.15 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.936 0.398 . . . . 0.0 111.513 -179.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -63.27 83.49 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.78 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.9 pp . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.855 -179.897 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 mm? . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.918 0.39 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 mp -143.47 143.02 31.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.048 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -19.83 55.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.727 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.6 -45.54 85.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.12 -55.65 20.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.301 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.44 ' O ' HG23 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -58.74 -28.18 65.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.894 179.816 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -71.17 -41.13 70.75 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.4 tp -62.13 -46.06 90.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.975 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.496 ' CG2' ' N ' ' A' ' 12' ' ' SER . 0.4 OUTLIER -62.99 -53.86 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 C-N-CA 120.506 -0.478 . . . . 0.0 109.743 179.174 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.496 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -55.83 -33.06 64.13 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 120.91 0.386 . . . . 0.0 110.433 179.503 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.01 -41.6 90.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.583 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.465 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -69.56 -42.44 72.53 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 177.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.9 mt -54.52 -59.52 4.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 113.844 -1.178 . . . . 0.0 109.32 178.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.419 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -59.59 -29.42 67.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.739 179.687 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.419 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 7.3 tt0 -68.47 -45.84 71.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.191 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.528 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.3 OUTLIER -74.3 -48.45 28.31 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.065 -179.825 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 77.7 p -55.69 -49.75 72.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.031 0.444 . . . . 0.0 110.353 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.454 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 91.3 t -68.24 -33.12 58.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.521 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.418 HD23 ' CZ2' ' A' ' 44' ' ' TRP . 4.5 tp -63.77 -45.9 87.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.798 0.333 . . . . 0.0 110.725 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 4.8 mt -68.5 -36.63 79.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.952 0.406 . . . . 0.0 110.196 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -82.53 -17.54 44.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.505 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.454 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 11.4 mt-30 -111.11 14.25 21.86 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -49.47 162.73 0.14 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.52 131.73 58.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 119.491 1.041 . . . . 0.0 111.372 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -105.7 124.72 50.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.939 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.543 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 3.1 m120 -149.53 147.2 27.9 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.739 -179.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.443 ' HA ' HD22 ' A' ' 31' ' ' LEU . 0.7 OUTLIER -116.74 117.32 37.81 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.284 179.057 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.434 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 29.2 Cg_endo -62.75 165.67 39.96 Favored 'Cis proline' 0 C--N 1.351 0.686 0 C-N-CA 123.879 -1.3 . . . . 0.0 112.784 0.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.543 ' HB3' ' O ' ' A' ' 28' ' ' ASN . 0.1 OUTLIER -126.64 167.05 16.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.024 179.797 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.2 p -70.41 143.67 14.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.195 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.96 172.14 14.17 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.278 0.561 . . . . 0.0 112.121 -178.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -62.34 -43.78 98.02 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.328 -178.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -34.83 78.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.127 0.489 . . . . 0.0 110.929 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -73.99 -36.95 64.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.656 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.419 ' HG2' ' CD2' ' A' ' 85' ' ' TYR . 3.5 tpt -66.81 -47.95 70.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.639 178.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.3 t -55.73 -45.79 79.44 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.236 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -58.12 -46.03 86.27 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.413 ' HA ' ' OD2' ' A' ' 43' ' ' ASP . 46.0 t -57.75 -41.53 79.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.996 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 21.6 t -70.43 -46.96 68.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.23 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.05 -47.5 80.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.031 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.586 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 3.3 p30 -68.96 -35.05 76.31 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.061 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.418 ' CZ2' HD23 ' A' ' 21' ' ' LEU . 3.9 m0 -60.72 -43.63 97.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.85 178.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.8 mtm -68.5 -45.71 71.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.661 -178.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.451 ' ND2' ' HA ' ' A' ' 43' ' ' ASP . 0.4 OUTLIER -71.58 -32.0 67.57 Favored 'General case' 0 CA--C 1.521 -0.154 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.914 179.707 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.586 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.96 -47.01 86.75 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.697 179.072 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.492 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 12.3 m-85 -65.88 -42.68 90.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.934 0.397 . . . . 0.0 110.582 179.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.4 mm -55.63 -55.44 17.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.364 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -72.33 -38.64 68.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.123 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.471 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 13.4 t80 -60.71 -46.38 90.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.998 -179.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.544 ' HA ' ' OE1' ' A' ' 55' ' ' GLN . 30.2 m-85 -75.6 -29.75 59.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.938 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.441 ' HA ' HD12 ' A' ' 67' ' ' LEU . 33.2 ttm180 -61.85 -27.95 69.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.826 0.346 . . . . 0.0 110.575 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -97.08 -16.01 20.71 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -178.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.544 ' OE1' ' HA ' ' A' ' 52' ' ' TYR . 6.0 pt20 -107.01 43.21 1.19 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -117.15 156.94 18.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.631 0.253 . . . . 0.0 110.364 178.538 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.4 p -131.08 171.46 13.22 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 85.24 -156.78 31.16 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.776 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -68.6 159.96 79.08 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.742 0.306 . . . . 0.0 111.034 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.4 -27.97 39.56 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.641 2.227 . . . . 0.0 112.333 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -42.25 99.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.848 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.45 -46.59 85.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.559 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.464 ' HD3' ' HB ' ' A' ' 56' ' ' VAL . 7.9 mtt180 -53.74 -51.84 62.06 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.8 -42.15 75.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.563 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.404 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 2.2 tttt -63.75 -31.94 73.28 Favored 'General case' 0 CA--C 1.522 -0.111 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.732 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.69 -40.74 65.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.463 HD11 ' O ' ' A' ' 63' ' ' ARG . 6.8 mp -71.71 -33.46 68.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.597 -179.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 5.5 pt20 -74.05 -48.97 26.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.868 0.366 . . . . 0.0 110.155 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -63.11 -33.19 74.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.476 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.416 HD12 ' CD2' ' A' ' 52' ' ' TYR . 2.7 mt -67.69 -49.33 63.29 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 67.9 ttp85 -55.41 -45.75 76.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.607 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -71.98 -32.78 67.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.202 0.525 . . . . 0.0 109.851 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -63.49 -46.92 83.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.068 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.44 HD21 ' CE2' ' A' ' 18' ' ' PHE . 0.9 OUTLIER -67.9 -45.25 74.96 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 121.085 0.469 . . . . 0.0 110.396 178.699 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.09 -39.39 63.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.915 -179.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.1 p -80.69 -33.74 35.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.982 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.435 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 4.9 mt -73.14 -31.21 64.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.968 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.34 -30.26 61.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -179.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.543 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.6 m-80 -56.4 -50.34 88.24 Favored Pre-proline 0 C--N 1.328 -0.327 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -179.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 54.1 Cg_endo -69.67 -38.96 7.26 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.415 2.077 . . . . 0.0 112.667 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.51 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 6.1 t80 -62.91 -53.47 53.55 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.011 0.434 . . . . 0.0 110.5 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.1 mt -56.02 -30.57 62.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.749 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.498 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.0 -43.24 75.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.957 0.408 . . . . 0.0 110.528 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.3 mtmt -62.2 -43.3 99.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.818 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.419 ' CD2' ' HG2' ' A' ' 37' ' ' MET . 0.2 OUTLIER -77.28 -33.55 55.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.875 -179.388 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.498 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 8.4 ptm180 -67.1 -38.5 85.76 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.75 -36.26 67.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.657 178.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.476 ' CZ ' ' CE1' ' A' ' 92' ' ' HIS . 15.0 t80 -71.55 -29.09 64.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.392 178.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -78.77 -45.3 21.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.653 178.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -71.23 -34.81 71.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.552 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.1 t -84.89 -5.6 59.34 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.476 ' CE1' ' CZ ' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -86.98 113.34 22.66 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.837 0.351 . . . . 0.0 111.253 -179.732 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -121.62 132.6 54.76 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.3 mt . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.001 -179.981 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.428 ' O ' ' HG ' ' A' ' 4' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 120.524 0.202 . . . . 0.0 111.17 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 2.7 pp 34.21 36.78 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.015 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.72 -29.21 64.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.024 0.44 . . . . 0.0 110.951 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.07 -47.28 83.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.022 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -62.26 -54.6 38.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.02 0.438 . . . . 0.0 110.27 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.43 -31.21 65.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.512 179.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -65.89 -45.04 83.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.146 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 tp -59.9 -45.1 93.6 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 37.3 mm -60.05 -54.22 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.2 p -51.09 -32.98 24.13 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.817 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.03 -44.9 71.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.407 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.474 ' HA3' ' HG2' ' A' ' 17' ' ' GLU . . . -66.55 -28.14 73.57 Favored Glycine 0 N--CA 1.452 -0.296 0 N-CA-C 110.694 -0.962 . . . . 0.0 110.694 177.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 mp -75.45 -60.68 2.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.388 -0.906 . . . . 0.0 110.964 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.7 ttpp -60.39 -36.81 78.95 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.712 0.291 . . . . 0.0 110.84 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.474 ' HG2' ' HA3' ' A' ' 14' ' ' GLY . 8.1 pt-20 -67.37 -47.73 69.52 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.486 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.43 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 1.3 t80 -65.98 -44.39 85.01 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.205 179.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 71.2 m -56.84 -51.59 68.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.591 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.7 t -63.42 -29.36 47.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.412 179.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.431 ' CD1' ' CH2' ' A' ' 44' ' ' TRP . 19.1 tp -70.26 -45.88 65.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.471 179.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.439 HD21 ' CD2' ' A' ' 81' ' ' PHE . 6.3 mt -65.95 -40.92 91.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.168 -179.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -82.52 -39.13 22.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.614 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.02 21.15 16.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.706 -179.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.556 ' O ' ' CB ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -36.06 -53.66 0.78 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.144 -179.855 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.556 ' CB ' ' O ' ' A' ' 25' ' ' GLN . 47.2 t 121.48 111.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.149 0.979 . . . . 0.0 110.405 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 8.2 m-30 -102.46 125.77 49.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.54 179.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.531 ' O ' ' HA ' ' A' ' 31' ' ' LEU . 1.4 m-80 -149.4 143.53 25.8 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.364 -179.45 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.44 ' HA ' ' N ' ' A' ' 31' ' ' LEU . 5.1 t70 -106.72 135.16 19.57 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.471 179.099 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -71.98 120.85 5.96 Favored 'Cis proline' 0 C--N 1.352 0.711 0 C-N-CA 123.834 -1.319 . . . . 0.0 112.382 0.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.531 ' HA ' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -60.33 160.67 8.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.256 -178.973 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.404 ' CG2' ' HB3' ' A' ' 36' ' ' ASP . 14.1 p -80.45 157.82 4.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.984 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.9 m -79.18 171.36 15.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.243 0.544 . . . . 0.0 111.687 -178.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.28 -37.5 77.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.943 -178.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.65 -32.96 74.6 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.955 0.407 . . . . 0.0 111.031 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.404 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -74.33 -39.51 62.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.985 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.432 ' HG2' ' CD2' ' A' ' 85' ' ' TYR . 4.4 tpp -67.53 -45.17 76.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.881 179.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 56.3 t -59.23 -44.35 91.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.611 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -61.05 -46.68 89.72 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.378 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 43.2 t -58.8 -43.77 88.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.874 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 13.8 t -65.29 -46.25 91.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.848 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.69 -45.22 85.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.565 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.43 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -66.46 -42.31 87.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.49 179.495 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.431 ' CH2' ' CD1' ' A' ' 21' ' ' LEU . 9.5 m0 -60.87 -38.97 87.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.895 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 42.5 mtm -71.06 -42.24 69.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.246 -178.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -72.01 -40.52 68.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.852 0.358 . . . . 0.0 110.302 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.452 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -63.65 -39.37 94.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.019 179.382 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.43 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 1.6 m-85 -66.47 -48.46 69.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.063 -179.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.47 ' O ' ' CG ' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -57.42 -55.75 19.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.758 -179.532 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -63.14 -38.68 92.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.932 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.452 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 4.3 t80 -62.85 -45.93 90.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.621 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.528 ' CD1' ' NE2' ' A' ' 55' ' ' GLN . 32.7 m-85 -70.51 -30.39 67.14 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -178.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.521 ' HA ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -61.23 -19.39 61.6 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.019 179.633 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -102.42 -16.69 16.11 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.142 0.794 . . . . 0.0 113.142 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.528 ' NE2' ' CD1' ' A' ' 52' ' ' TYR . 0.7 OUTLIER -100.18 46.16 0.96 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 120.617 -0.433 . . . . 0.0 112.081 -179.307 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.515 ' HB ' ' HD3' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -120.08 159.72 21.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.961 0.41 . . . . 0.0 111.106 179.396 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.6 p -134.71 171.74 13.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 82.56 -161.71 40.88 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.273 -0.965 . . . . 0.0 112.95 179.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.77 162.72 26.32 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-O 120.816 0.341 . . . . 0.0 111.007 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.56 -32.02 32.16 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.567 2.178 . . . . 0.0 112.557 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.54 -42.53 96.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.008 0.432 . . . . 0.0 111.047 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -62.35 -46.76 87.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.528 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.528 ' O ' HD11 ' A' ' 67' ' ' LEU . 5.5 mtt180 -53.56 -52.13 60.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.286 0.565 . . . . 0.0 109.492 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -55.42 -42.23 73.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.45 -178.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 1.0 OUTLIER -61.76 -34.65 76.23 Favored 'General case' 0 CA--C 1.521 -0.137 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.506 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.59 66.83 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.086 179.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.528 HD11 ' O ' ' A' ' 63' ' ' ARG . 1.1 mp -66.08 -38.69 88.9 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.709 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.426 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 0.6 OUTLIER -70.01 -44.66 68.85 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.231 179.843 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.3 -34.28 76.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.405 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.425 HD13 ' CD2' ' A' ' 52' ' ' TYR . 0.5 OUTLIER -65.1 -49.65 69.16 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.14 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.3 ttm-85 -55.28 -48.7 73.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.861 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.439 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.1 OUTLIER -68.68 -31.21 70.16 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.187 0.518 . . . . 0.0 110.092 179.196 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 0.0 OUTLIER -62.17 -45.7 92.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.948 179.761 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.61 -44.39 78.18 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.147 0.499 . . . . 0.0 110.29 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -52.25 -43.43 64.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.142 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.47 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 66.6 m -79.95 -50.48 10.36 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.708 0.289 . . . . 0.0 111.246 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 4.4 mt -56.69 -37.94 71.57 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.43 -37.05 77.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -178.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.512 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.1 t30 -51.65 -50.54 76.66 Favored Pre-proline 0 CA--C 1.534 0.335 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 53.2 Cg_endo -69.94 -34.68 13.51 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.583 2.189 . . . . 0.0 113.338 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.439 ' CD2' HD21 ' A' ' 22' ' ' LEU . 1.4 t80 -64.41 -53.79 42.99 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.698 0.285 . . . . 0.0 110.76 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.1 mt -53.94 -29.93 44.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.65 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.09 -44.7 65.16 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.257 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.0 -43.05 81.35 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.586 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.432 ' CD2' ' HG2' ' A' ' 37' ' ' MET . 0.3 OUTLIER -73.44 -33.33 64.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.942 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -46.09 83.81 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.93 -32.23 70.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.932 178.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.511 ' CE2' ' CD2' ' A' ' 27' ' ' PHE . 5.6 t80 -72.1 -28.76 63.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.448 179.112 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.07 -44.92 24.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.022 179.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.78 -38.75 62.08 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.503 -179.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 54.2 m -64.97 -16.24 63.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.997 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.492 ' CE1' ' CD1' ' A' ' 31' ' ' LEU . 26.8 m170 -76.59 105.38 7.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.913 0.387 . . . . 0.0 111.233 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -54.86 99.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.999 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.3 pp . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.913 179.959 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.88 0.371 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 18.5 mt -109.66 -27.12 9.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.01 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -24.57 23.67 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.937 0.399 . . . . 0.0 110.672 179.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.09 -43.95 74.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.557 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -65.07 -48.25 74.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.431 179.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.547 ' O ' HG23 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -63.65 -28.25 69.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.954 179.926 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -72.76 -44.35 61.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.863 0.363 . . . . 0.0 110.213 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.462 HD22 ' CD2' ' A' ' 52' ' ' TYR . 5.1 tp -59.86 -49.29 78.29 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.361 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.547 HG23 ' O ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -57.25 -49.73 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.042 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -55.24 -33.02 62.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.757 179.324 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.92 -44.13 77.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.378 -179.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.477 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -69.59 -40.18 77.89 Favored Glycine 0 C--O 1.229 -0.175 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 177.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.3 mt -54.48 -59.21 4.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 113.761 -1.22 . . . . 0.0 109.557 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.0 pttm -59.57 -31.02 69.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.418 179.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.2 -46.9 75.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.129 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.57 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -64.11 -49.17 73.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.095 -179.817 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 98.0 p -55.17 -51.41 66.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.875 0.369 . . . . 0.0 111.065 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.449 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 38.1 t -61.42 -40.58 86.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.155 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.47 -46.11 84.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.081 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 33.0 mt -62.99 -36.54 83.86 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.301 -179.289 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -82.65 -22.42 34.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.602 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.495 ' C ' ' H ' ' A' ' 26' ' ' VAL . 1.7 mt-30 -117.4 21.86 12.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.668 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.522 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -66.01 37.08 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -179.162 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.522 ' O ' ' O ' ' A' ' 25' ' ' GLN . 18.4 t 31.6 112.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 178.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.466 ' HB3' ' CZ ' ' A' ' 88' ' ' PHE . 34.0 m-85 -107.25 96.09 6.17 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.357 0.599 . . . . 0.0 110.627 178.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.406 ' O ' ' O ' ' A' ' 30' ' ' PRO . 0.5 OUTLIER -122.98 152.75 40.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.613 -179.213 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.657 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 4.2 p-10 -106.18 139.81 20.65 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.99 179.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.657 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 13.3 Cg_endo -55.85 163.57 14.48 Favored 'Cis proline' 0 C--N 1.355 0.888 0 C-N-CA 124.315 -1.119 . . . . 0.0 112.513 0.103 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.517 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.9 mp -109.44 150.86 27.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.664 -179.281 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.407 ' CG2' ' CB ' ' A' ' 36' ' ' ASP . 13.8 p -76.45 148.9 6.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.33 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.4 m -79.77 172.41 13.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.144 0.497 . . . . 0.0 111.503 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.56 -38.95 84.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.732 -179.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -66.74 -37.31 84.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.164 0.507 . . . . 0.0 110.344 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.407 ' CB ' ' CG2' ' A' ' 32' ' ' VAL . 1.1 m-20 -68.55 -39.32 81.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.612 178.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -41.66 89.89 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.478 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 96.7 t -55.85 -47.94 78.98 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.915 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -46.92 85.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.988 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 39.1 t -55.63 -52.03 52.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.76 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 38.9 t -61.03 -42.91 94.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.446 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.41 -50.24 74.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.451 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.466 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -59.18 -46.3 88.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.439 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 16.0 m0 -60.7 -40.45 92.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.583 179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.2 ttp -67.74 -42.9 81.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.8 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -73.51 -34.75 65.41 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.466 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.89 -45.22 90.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.763 179.157 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -65.45 -46.5 79.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.273 -179.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.439 ' CD1' ' HB2' ' A' ' 71' ' ' ARG . 0.6 OUTLIER -58.53 -55.5 22.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.66 -179.772 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.428 ' HA ' ' HG3' ' A' ' 53' ' ' ARG . 18.1 t30 -62.47 -42.21 99.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.781 179.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.505 ' CD1' ' OE1' ' A' ' 55' ' ' GLN . 13.8 t80 -60.13 -48.89 79.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.771 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.544 ' HA ' ' CD ' ' A' ' 55' ' ' GLN . 5.3 m-85 -64.5 -33.66 76.41 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -179.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.433 ' CG ' ' O ' ' A' ' 49' ' ' ILE . 5.8 mtm105 -56.37 -26.35 52.62 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.375 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -99.26 -16.15 18.61 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.544 ' CD ' ' HA ' ' A' ' 52' ' ' TYR . 1.9 pt20 -103.4 38.9 1.68 Allowed 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.658 ' HB ' ' HD2' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -110.56 159.13 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 178.465 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.0 m -129.58 171.5 12.53 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 87.36 -155.9 27.61 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.893 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.2 160.33 83.01 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.706 0.289 . . . . 0.0 110.829 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.472 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 27.2 Cg_endo -62.23 -32.64 82.41 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.68 2.253 . . . . 0.0 112.718 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -62.47 -43.11 99.61 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.213 0.53 . . . . 0.0 110.871 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -60.68 -40.9 93.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.016 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.658 ' HD2' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -58.08 -50.95 71.69 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.686 179.271 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.37 -41.67 72.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.391 -179.039 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.7 tttm -66.52 -49.86 65.12 Favored 'General case' 0 CA--C 1.522 -0.112 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.278 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.42 -37.29 72.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.69 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.56 HD11 ' N ' ' A' ' 67' ' ' LEU . 8.1 mp -66.67 -41.81 87.57 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.093 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.414 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 1.7 pp0? -67.82 -41.7 82.67 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.85 0.357 . . . . 0.0 110.318 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.414 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 0.5 OUTLIER -62.25 -38.61 89.92 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.248 179.691 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.446 ' HG ' ' CG ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -61.4 -48.7 80.03 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.011 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.439 ' HB2' ' CD1' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -55.27 -48.97 73.25 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.088 -179.66 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.6 -32.67 72.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.075 0.464 . . . . 0.0 110.223 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -60.59 -45.59 93.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.953 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 10.1 mt -67.76 -44.44 77.49 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.022 0.439 . . . . 0.0 110.521 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -52.64 -42.78 64.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.227 -179.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.1 m -78.29 -32.74 49.59 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.023 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.411 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 2.7 mt -72.72 -30.67 64.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.844 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.79 -28.87 60.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.553 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.7 t30 -58.49 -50.17 89.5 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.822 0.304 . . . . 0.0 111.822 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.553 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 46.7 Cg_endo -69.03 -41.01 5.65 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.462 2.108 . . . . 0.0 113.014 -179.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.494 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 5.1 t80 -58.21 -50.18 74.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.033 0.444 . . . . 0.0 110.869 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.1 mt -54.53 -37.24 65.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.327 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.24 -44.27 79.86 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.771 0.319 . . . . 0.0 110.615 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.83 -40.88 76.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.067 0.46 . . . . 0.0 110.34 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -76.15 -33.36 59.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.632 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.41 ' HG2' ' N ' ' A' ' 87' ' ' ASP . 0.0 OUTLIER -61.12 -45.92 92.73 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.054 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.41 ' N ' ' HG2' ' A' ' 86' ' ' ARG . 0.4 OUTLIER -71.05 -33.57 70.4 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.071 178.939 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.517 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 16.8 t80 -69.59 -28.81 66.28 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.263 178.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -44.58 62.2 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 178.23 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.81 -31.07 71.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.907 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 m -60.53 -10.72 5.44 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -176.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -52.45 159.37 1.03 Allowed 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 178.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -123.53 81.98 1.96 Allowed 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 119.154 0.888 . . . . 0.0 111.787 178.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.834 -179.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 pt? . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.726 0.298 . . . . 0.0 111.146 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.6 pp -132.23 -50.46 0.94 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.057 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.466 ' HA ' ' HG2' ' A' ' 8' ' ' LYS . 2.5 ttpt -77.46 -42.38 36.16 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.733 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.74 -45.14 95.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.382 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -60.93 -50.28 74.05 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.713 179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.466 ' HG2' ' HA ' ' A' ' 5' ' ' LYS . 0.3 OUTLIER -61.94 -28.3 69.44 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.12 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.406 ' N ' ' HG3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -74.79 -46.17 38.71 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.495 -179.79 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.57 -49.06 79.22 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.487 ' CG2' ' N ' ' A' ' 12' ' ' SER . 1.2 tt -56.77 -51.64 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.22 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.487 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 3.5 m -51.12 -33.44 26.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.361 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.54 -47.3 55.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.867 0.365 . . . . 0.0 111.085 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -66.93 -27.99 73.62 Favored Glycine 0 C--O 1.229 -0.162 0 N-CA-C 110.169 -1.173 . . . . 0.0 110.169 177.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -71.32 -61.25 1.84 Allowed 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.328 -0.936 . . . . 0.0 110.159 179.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -57.74 -36.78 72.54 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.37 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -63.95 -49.61 71.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.677 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.533 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -67.52 -42.53 82.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.956 -179.476 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.1 m -55.48 -50.13 70.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.001 0.429 . . . . 0.0 110.942 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.43 ' O ' ' CB ' ' A' ' 24' ' ' GLN . 24.7 t -66.47 -39.33 83.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.637 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.461 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 2.8 tp -64.27 -46.13 85.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.743 0.306 . . . . 0.0 111.462 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -65.87 -42.35 90.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.05 -179.403 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -82.6 -17.96 42.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.911 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.43 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 13.3 tt0 -117.66 21.61 12.86 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -179.127 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.55 ' O ' ' CB ' ' A' ' 26' ' ' VAL . 0.6 OUTLIER -49.6 -67.35 0.27 Allowed 'General case' 0 C--N 1.331 -0.23 0 O-C-N 122.388 -0.195 . . . . 0.0 111.151 179.757 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.55 ' CB ' ' O ' ' A' ' 25' ' ' GLN . 50.2 t 120.57 119.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.161 0.984 . . . . 0.0 110.667 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -105.36 101.15 10.7 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.977 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -125.33 142.08 51.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.892 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.04 154.01 93.4 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.823 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -83.37 25.41 9.16 Favored 'Cis proline' 0 C--N 1.346 0.429 0 C-N-CA 123.345 -1.523 . . . . 0.0 112.949 0.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.432 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.0 OUTLIER 68.79 136.39 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.985 0.421 . . . . 0.0 111.205 179.893 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 5.5 p -80.72 157.25 4.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.634 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.67 171.19 15.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.134 0.492 . . . . 0.0 111.5 -178.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -32.0 68.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.28 -179.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.08 -35.98 82.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.013 0.435 . . . . 0.0 110.196 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -70.7 -42.37 70.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.855 179.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.1 -44.79 94.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.815 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.3 t -57.11 -47.27 84.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.699 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.402 ' CG2' ' N ' ' A' ' 40' ' ' VAL . 0.5 OUTLIER -63.52 -47.36 81.97 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.48 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.402 ' N ' ' CG2' ' A' ' 39' ' ' THR . 41.7 t -59.33 -42.94 88.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.725 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 54.8 t -66.3 -48.6 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.476 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.08 -44.67 83.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.349 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -59.07 -48.42 81.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.435 179.506 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.461 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 32.5 m0 -60.84 -41.12 95.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.462 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 22.5 ttm -67.77 -43.0 80.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.64 -179.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -73.22 -33.26 65.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.987 0.422 . . . . 0.0 109.906 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.472 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -62.54 -41.89 99.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.856 179.151 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -70.65 -43.02 70.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.707 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.422 ' CD1' ' HB3' ' A' ' 71' ' ' ARG . 2.2 mm -56.23 -55.1 20.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.966 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.0 m-80 -68.36 -40.14 81.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.01 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.414 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.5 t80 -59.06 -53.66 55.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.466 ' CD2' ' CD2' ' A' ' 70' ' ' LEU . 23.5 m-85 -68.8 -28.52 66.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.405 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.403 ' HA ' ' CD2' ' A' ' 67' ' ' LEU . 42.2 ttm-85 -59.72 -28.96 67.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.07 0.462 . . . . 0.0 110.16 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.3 -9.42 19.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.792 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -95.64 11.96 31.44 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -178.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.627 ' HB ' ' CG ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -94.89 177.05 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.236 0.541 . . . . 0.0 111.615 -179.813 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 35.0 p -149.53 171.74 16.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.299 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 80.33 -173.98 54.93 Favored Glycine 0 CA--C 1.519 0.296 0 C-N-CA 120.241 -0.98 . . . . 0.0 114.015 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -52.7 152.26 7.04 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.274 -0.463 . . . . 0.0 111.418 -179.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.424 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 14.1 Cg_endo -56.82 -33.35 94.34 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.121 2.547 . . . . 0.0 113.3 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.33 -43.17 98.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.134 0.492 . . . . 0.0 110.912 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.53 -46.77 86.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.642 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.627 ' CG ' ' HB ' ' A' ' 56' ' ' VAL . 0.4 OUTLIER -54.52 -51.88 63.75 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 121.036 0.445 . . . . 0.0 110.045 179.937 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.01 -42.07 75.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.058 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.476 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 25.1 tttm -61.96 -35.07 77.36 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 120.946 0.403 . . . . 0.0 110.989 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.454 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -70.68 -40.88 72.67 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.611 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.445 HD11 ' O ' ' A' ' 63' ' ' ARG . 6.7 mp -70.24 -33.01 71.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.634 -179.616 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.518 ' HA ' ' HG2' ' A' ' 71' ' ' ARG . 12.1 pt20 -74.71 -48.3 26.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.836 0.35 . . . . 0.0 110.169 179.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.43 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 3.9 mm-40 -62.25 -34.03 75.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.491 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.466 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -68.94 -49.31 59.18 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.4 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.527 ' HG3' ' N ' ' A' ' 72' ' ' GLN . 0.5 OUTLIER -55.48 -37.9 68.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.406 -179.999 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.527 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 36.8 mt-30 -71.56 -34.27 69.83 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -41.13 98.68 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.523 179.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.4 mt -67.9 -45.15 75.21 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.22 0.533 . . . . 0.0 109.748 178.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -52.35 -41.93 63.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.662 -179.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.466 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 1.1 p -77.32 -50.58 12.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.584 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.403 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 4.0 mt -54.56 -37.73 65.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.068 -179.247 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.2 -27.39 59.58 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.553 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.4 t-20 -52.9 -50.29 82.36 Favored Pre-proline 0 CA--C 1.532 0.268 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.553 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 46.9 Cg_endo -68.8 -36.77 13.04 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.381 2.054 . . . . 0.0 112.609 -179.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.508 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 3.3 t80 -68.43 -54.42 17.22 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.008 0.433 . . . . 0.0 110.163 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 19.6 mt -57.15 -37.46 72.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.153 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.464 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -67.98 -40.74 83.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.848 0.356 . . . . 0.0 110.764 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.64 -39.63 91.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.038 0.447 . . . . 0.0 110.171 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -77.53 -38.04 49.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.931 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 14.4 ptt180 -62.46 -47.95 81.78 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.476 ' HA ' ' HG2' ' A' ' 90' ' ' LYS . 0.4 OUTLIER -63.11 -39.81 95.78 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.264 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.432 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 6.1 t80 -64.56 -28.45 69.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.742 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.1 mp -75.22 -44.83 44.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.899 179.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.476 ' HG2' ' HA ' ' A' ' 87' ' ' ASP . 1.6 ptpt -67.14 -34.45 77.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.739 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.4 -2.6 0.75 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.404 ' H ' ' C ' ' A' ' 90' ' ' LYS . 3.3 m-70 -60.92 175.71 0.47 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 177.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -115.12 159.46 20.85 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.52 179.663 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.758 0.313 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.94 92.22 3.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.063 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.48 -25.48 25.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.006 0.432 . . . . 0.0 110.761 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.18 -46.31 84.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.691 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 40.0 m-20 -63.43 -53.06 58.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.364 179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -33.11 73.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.959 179.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -64.74 -42.04 95.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.93 0.395 . . . . 0.0 110.08 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.402 HD23 ' HB2' ' A' ' 55' ' ' GLN . 0.9 OUTLIER -63.14 -44.83 94.46 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.659 178.959 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 37.0 mt -60.52 -54.25 37.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.436 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 79.5 p -52.18 -41.98 63.08 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-O 120.828 0.347 . . . . 0.0 110.646 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.33 -40.91 83.36 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.033 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.43 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -68.62 -27.95 73.48 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 176.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.429 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.2 OUTLIER -71.22 -61.63 1.7 Allowed 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 114.478 -0.861 . . . . 0.0 111.166 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.436 ' HG2' ' O ' ' A' ' 12' ' ' SER . 6.6 mmtm -59.19 -33.81 71.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.267 0.556 . . . . 0.0 109.951 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -62.69 -50.87 69.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.877 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.488 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -74.34 -41.75 60.55 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.849 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 80.2 p -62.27 -51.64 66.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.804 0.335 . . . . 0.0 110.662 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 54.2 t -65.86 -35.44 75.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.444 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.844 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 1.9 tp -68.9 -43.62 74.86 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.037 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 1.5 mt -69.41 -31.36 69.67 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.703 0.261 . . . . 0.0 111.703 -179.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -75.71 -28.94 58.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.516 ' C ' ' H ' ' A' ' 26' ' ' VAL . 4.1 mp0 -117.66 -51.53 2.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.324 0.583 . . . . 0.0 111.547 -179.454 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.844 ' HG3' ' O ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER 64.44 -36.18 0.18 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.778 179.074 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.516 ' H ' ' C ' ' A' ' 24' ' ' GLN . 4.7 t 80.91 109.62 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.812 0.339 . . . . 0.0 110.359 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.517 ' CZ ' ' CE1' ' A' ' 85' ' ' TYR . 20.7 m-85 -129.63 106.8 8.98 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.754 0.788 . . . . 0.0 111.819 -178.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -113.28 170.3 8.32 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.323 178.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.443 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 0.7 OUTLIER -96.97 135.58 21.97 Favored Pre-proline 0 C--N 1.315 -0.921 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.459 179.567 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.443 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 42.9 Cg_endo -67.34 151.69 84.36 Favored 'Cis proline' 0 C--N 1.351 0.661 0 C-N-CA 123.79 -1.338 . . . . 0.0 112.528 -0.011 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 mt -95.06 142.75 27.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.24 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.431 ' CG2' ' CB ' ' A' ' 36' ' ' ASP . 13.8 p -78.59 146.51 7.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.239 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.1 p -79.73 171.69 14.79 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.077 0.465 . . . . 0.0 112.006 -178.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -63.52 -48.09 78.98 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.317 -178.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -59.24 -33.4 70.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.516 0.674 . . . . 0.0 110.117 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.431 ' CB ' ' CG2' ' A' ' 32' ' ' VAL . 1.1 m-20 -73.22 -33.25 65.25 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.055 178.121 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.53 ' HG3' ' CD2' ' A' ' 85' ' ' TYR . 0.0 OUTLIER -67.43 -47.27 70.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.451 178.27 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.8 t -55.7 -46.52 79.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.299 179.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -44.52 88.18 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.4 t -57.96 -48.15 84.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.54 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 43.1 t -59.91 -48.73 86.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.655 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.05 -45.08 75.25 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.324 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.575 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -66.41 -43.59 85.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.029 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.407 ' CZ3' HD22 ' A' ' 21' ' ' LEU . 8.3 m0 -62.25 -43.31 99.11 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.175 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.423 ' HA ' ' CD1' ' A' ' 74' ' ' LEU . 16.7 mtm -67.75 -43.62 79.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.044 -178.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -72.65 -34.87 67.57 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.235 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.575 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -65.91 -42.98 89.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.033 179.158 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -67.3 -48.32 67.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.847 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.511 ' O ' ' CG ' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -59.58 -55.42 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.405 -179.484 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.436 ' N ' ' CG2' ' A' ' 49' ' ' ILE . 11.0 t30 -60.15 -41.16 92.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.967 0.413 . . . . 0.0 110.907 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.498 ' CG ' ' OE1' ' A' ' 55' ' ' GLN . 6.3 t80 -62.33 -50.97 69.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.717 -179.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.453 ' HA ' ' OE1' ' A' ' 55' ' ' GLN . 17.4 m-85 -64.79 -30.78 71.8 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -178.424 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.511 ' CG ' ' O ' ' A' ' 49' ' ' ILE . 2.1 mtt180 -58.97 -21.53 58.75 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 119.923 -0.711 . . . . 0.0 110.447 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -100.7 -18.7 16.39 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.498 ' OE1' ' CG ' ' A' ' 51' ' ' TYR . 2.5 mt-30 -93.6 47.15 1.22 Allowed 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 120.83 -0.348 . . . . 0.0 111.141 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.496 ' HB ' ' HB3' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -128.82 165.84 27.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.312 0.577 . . . . 0.0 112.3 -179.633 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.82 171.74 14.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.204 -0.907 . . . . 0.0 108.867 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 83.7 -170.83 48.58 Favored Glycine 0 CA--C 1.516 0.154 0 C-N-CA 120.202 -0.999 . . . . 0.0 113.018 179.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.23 145.51 73.91 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-O 120.661 0.267 . . . . 0.0 111.067 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.459 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 12.0 Cg_endo -55.03 -19.96 21.84 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.931 2.421 . . . . 0.0 112.794 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.34 -40.75 77.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.798 0.332 . . . . 0.0 110.972 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.36 -47.01 71.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.39 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.496 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -60.17 -50.75 72.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.462 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -54.58 -41.18 69.57 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.999 -179.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -60.48 -49.74 76.34 Favored 'General case' 0 CA--C 1.523 -0.078 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.113 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.418 ' O ' ' HG2' ' A' ' 69' ' ' GLU . . . -57.2 -39.61 75.76 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.78 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 63' ' ' ARG . 3.6 mp -68.77 -37.98 79.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.12 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -70.81 -46.45 62.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.904 0.383 . . . . 0.0 110.271 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 66' ' ' ALA . 8.7 pt-20 -62.19 -35.93 80.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.108 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.405 ' HB3' HD13 ' A' ' 49' ' ' ILE . 0.3 OUTLIER -63.33 -49.52 73.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.74 179.404 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.7 ttt-85 -55.46 -46.28 76.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.792 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.424 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -68.11 -38.35 82.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.15 0.5 . . . . 0.0 110.127 179.403 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.45 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 3.1 tp10 -64.47 -35.92 82.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.64 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.423 ' CD1' ' HA ' ' A' ' 45' ' ' MET . 0.1 OUTLIER -68.55 -46.31 69.82 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.282 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -52.57 -39.24 61.32 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.956 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.524 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 6.8 t -80.86 -48.61 12.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.811 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.45 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 2.0 mt -58.18 -40.72 82.22 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.25 75.93 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.52 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.9 m120 -51.03 -50.37 75.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -177.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.524 ' CD ' ' O ' ' A' ' 76' ' ' THR . 55.6 Cg_endo -69.87 -27.7 25.63 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.377 2.051 . . . . 0.0 113.139 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.455 ' CE1' ' HG2' ' A' ' 25' ' ' GLN . 1.2 t80 -65.49 -53.58 40.52 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.686 0.279 . . . . 0.0 111.123 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 61.5 mt -53.39 -29.88 37.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.762 0.315 . . . . 0.0 110.441 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.89 -42.1 63.95 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -58.39 -43.19 88.43 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.564 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.53 ' CD2' ' HG3' ' A' ' 37' ' ' MET . 0.4 OUTLIER -72.38 -34.83 68.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.474 179.84 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -45.74 89.6 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -71.58 -30.02 65.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.921 178.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -70.34 -29.25 65.9 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.155 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -76.2 -44.29 38.5 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.15 -33.62 73.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.499 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.3 p -60.62 -15.44 28.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.97 -178.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 22.4 m80 -52.71 175.33 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -77.3 144.17 38.29 Favored 'General case' 0 C--N 1.33 -0.242 0 O-C-N 122.132 -0.355 . . . . 0.0 110.89 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.0 mp . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.861 179.924 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.976 0.417 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.4 pp -126.2 13.94 7.78 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.323 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.47 -27.33 51.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.805 0.336 . . . . 0.0 111.0 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.79 -48.27 81.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.435 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -62.81 -52.26 63.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.282 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.436 ' O ' HG23 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -59.43 -28.32 66.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.015 179.732 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -71.55 -45.26 62.81 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.495 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.84 -46.64 88.61 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.484 ' CG2' ' N ' ' A' ' 12' ' ' SER . 3.7 tt -61.74 -53.73 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.828 179.208 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.484 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 8.0 t -57.38 -33.14 67.52 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-O 120.596 0.236 . . . . 0.0 111.478 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.29 78.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.287 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.449 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -71.74 -33.7 63.13 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 177.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.42 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.7 mm? -58.51 -61.16 2.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.093 -1.053 . . . . 0.0 109.51 178.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.409 ' HD2' ' CG2' ' A' ' 20' ' ' VAL . 0.4 OUTLIER -57.57 -35.48 70.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.219 0.533 . . . . 0.0 110.068 179.551 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.34 -48.57 80.7 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.536 179.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.512 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -70.57 -47.18 61.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.843 -179.944 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 89.3 p -55.49 -49.12 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.851 0.358 . . . . 0.0 110.709 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.409 ' CG2' ' HD2' ' A' ' 16' ' ' LYS . 47.8 t -68.08 -31.72 53.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.597 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.468 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 6.2 tp -66.23 -45.69 79.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.825 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 8.2 mt -68.68 -38.93 80.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.222 -179.528 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.28 -27.37 32.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.823 0.344 . . . . 0.0 111.109 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.524 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -112.04 21.56 15.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.109 -179.783 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.66 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -66.25 37.25 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -179.199 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.66 ' O ' ' O ' ' A' ' 25' ' ' GLN . 6.1 m 15.24 125.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 179.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.412 ' HB3' ' CE2' ' A' ' 88' ' ' PHE . 17.8 m-85 -114.22 96.06 5.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.319 178.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -146.63 140.92 26.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.346 -179.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.433 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 1.3 p30 -61.1 144.24 91.29 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.863 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.433 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 56.4 Cg_endo -69.96 128.98 13.7 Favored 'Cis proline' 0 C--N 1.351 0.675 0 C-N-CA 123.5 -1.458 . . . . 0.0 112.418 -0.114 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.2 mt -72.56 127.3 32.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.971 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.435 ' CG2' ' HB3' ' A' ' 36' ' ' ASP . 9.6 p -73.42 142.29 15.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.31 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.0 t -79.86 172.5 13.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.154 0.502 . . . . 0.0 111.618 -178.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.52 -40.64 89.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.918 -179.017 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -66.16 -36.83 84.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.246 0.545 . . . . 0.0 110.246 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.435 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 8.9 t0 -71.62 -35.47 70.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.485 178.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -68.37 -44.47 75.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.59 178.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.9 t -56.25 -47.44 80.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.244 179.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -59.35 -46.74 87.79 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.049 179.262 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 42.5 t -58.59 -44.59 89.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.532 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 30.9 t -62.98 -48.91 85.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.487 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.96 -44.11 70.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.49 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.456 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -67.63 -39.05 84.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.422 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.468 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 7.3 m0 -62.84 -44.98 94.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 53.2 mtm -67.13 -45.78 76.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.416 -178.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -66.52 -41.72 88.38 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.436 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.458 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -59.38 -43.35 92.91 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.875 179.177 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.505 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 7.1 m-85 -61.13 -52.0 66.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.61 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -54.43 -55.17 16.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.228 -179.295 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -64.74 -35.58 81.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.098 0.475 . . . . 0.0 110.234 179.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.551 ' CE1' ' NE2' ' A' ' 55' ' ' GLN . 6.3 t80 -64.8 -35.06 79.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.986 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.505 ' CE2' ' HB3' ' A' ' 48' ' ' TYR . 26.0 m-85 -75.78 -35.52 60.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.745 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.502 ' CB ' HD13 ' A' ' 67' ' ' LEU . 0.1 OUTLIER -60.65 -29.4 69.25 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.692 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -93.62 -14.8 26.04 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -178.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.551 ' NE2' ' CE1' ' A' ' 51' ' ' TYR . 3.5 mt-30 -104.89 43.72 1.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.561 ' HB ' ' CG ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -127.67 168.24 21.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.873 0.368 . . . . 0.0 111.02 178.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.6 p -139.4 171.25 14.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.825 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.65 -152.88 25.48 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.472 -0.871 . . . . 0.0 112.92 179.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.68 152.75 89.41 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-O 120.848 0.356 . . . . 0.0 111.163 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.453 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 43.7 Cg_endo -67.74 -22.33 43.58 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.737 2.291 . . . . 0.0 113.053 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -63.4 -42.02 98.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.668 -179.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.38 -39.73 81.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.257 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.561 ' CG ' ' HB ' ' A' ' 56' ' ' VAL . 1.2 mpt_? -59.32 -51.17 71.1 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.249 0.547 . . . . 0.0 109.595 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.97 -41.14 86.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.855 -179.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.48 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 9.9 tttp -68.04 -50.11 57.31 Favored 'General case' 0 C--N 1.338 0.092 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.585 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.61 -32.39 70.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.503 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.502 HD13 ' CB ' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -71.71 -40.17 69.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.435 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.524 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 3.0 pt20 -66.62 -36.84 83.56 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.524 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.2 tt0 -69.24 -35.09 75.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.002 179.259 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.463 ' CD1' ' CD2' ' A' ' 52' ' ' TYR . 4.0 mt -65.49 -49.27 69.68 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.45 -48.89 73.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.317 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.503 ' HG2' ' HA ' ' A' ' 69' ' ' GLU . 7.7 pt20 -64.14 -36.52 84.3 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 178.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 2.9 tp10 -63.08 -37.22 86.34 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.512 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.43 HD22 ' CE2' ' A' ' 18' ' ' PHE . 23.9 mt -68.16 -45.68 72.83 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.3 m120 -52.95 -38.46 62.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.863 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.441 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 5.6 t -80.86 -49.3 11.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.508 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.8 mt -56.44 -35.25 67.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.205 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.62 -31.67 62.06 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.54 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.2 t-20 -51.65 -50.16 78.81 Favored Pre-proline 0 CA--C 1.533 0.319 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 55.5 Cg_endo -69.84 -32.33 18.43 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.442 2.095 . . . . 0.0 113.119 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.504 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 6.2 t80 -65.89 -53.67 36.6 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.886 0.374 . . . . 0.0 110.914 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.6 mt -56.33 -31.31 63.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.756 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 86' ' ' ARG . . . -69.08 -46.18 68.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.834 0.35 . . . . 0.0 110.392 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -58.02 -42.47 85.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.698 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.41 ' OH ' ' CG1' ' A' ' 32' ' ' VAL . 0.5 OUTLIER -73.03 -33.55 65.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.0 -179.933 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.517 ' HG3' ' N ' ' A' ' 87' ' ' ASP . 0.0 OUTLIER -63.03 -39.4 94.62 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.935 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.517 ' N ' ' HG3' ' A' ' 86' ' ' ARG . 6.7 m-20 -72.8 -32.44 65.56 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.029 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.418 ' O ' ' CD2' ' A' ' 92' ' ' HIS . 7.7 t80 -71.14 -28.92 64.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.713 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp -78.43 -45.04 23.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.456 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.6 mmtt -76.5 -40.37 50.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.007 -178.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 36.4 m -71.83 -13.03 61.56 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.994 -179.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.418 ' CD2' ' O ' ' A' ' 88' ' ' PHE . 1.5 m-70 -57.97 104.92 0.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.917 0.389 . . . . 0.0 110.675 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -50.97 138.36 19.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.432 0.634 . . . . 0.0 112.378 -178.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.4 mp . . . . . 0 C--O 1.248 1.003 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.97 179.725 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.587 ' O ' ' N ' ' A' ' 5' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.439 0 N-CA-C 111.638 0.236 . . . . 0.0 111.638 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.402 ' HG ' ' C ' ' A' ' 3' ' ' LEU . 0.1 OUTLIER 34.41 -79.01 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 179.783 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.587 ' N ' ' O ' ' A' ' 3' ' ' LEU . 0.1 OUTLIER -50.12 -31.02 12.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.588 -178.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.417 ' CB ' ' HB2' ' A' ' 3' ' ' LEU . . . -58.83 -45.43 90.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.846 0.355 . . . . 0.0 110.703 179.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -64.42 -47.93 77.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.22 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.493 ' O ' HG21 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -61.46 -28.1 69.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.954 179.779 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.87 -45.25 52.11 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.47 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.6 tp -61.63 -46.38 90.03 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.106 0.479 . . . . 0.0 109.713 178.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.493 HG21 ' O ' ' A' ' 8' ' ' LYS . 2.6 tt -61.36 -53.6 46.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.648 179.009 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.492 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 6.6 t -52.12 -33.09 38.33 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.909 0.385 . . . . 0.0 110.554 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -67.79 -41.72 82.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.75 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.496 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -70.88 -35.98 65.56 Favored Glycine 0 C--O 1.23 -0.141 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mp -59.75 -61.01 2.93 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 113.829 -1.186 . . . . 0.0 109.929 179.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.429 ' HD2' ' CG2' ' A' ' 20' ' ' VAL . 1.3 tptp -59.06 -37.09 76.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.229 0.538 . . . . 0.0 110.253 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 6.7 tp10 -61.3 -46.85 88.58 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.386 179.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.466 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.3 OUTLIER -71.12 -49.32 45.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.1 -179.781 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 91.3 p -55.85 -46.36 78.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.907 0.385 . . . . 0.0 110.419 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.477 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 63.0 t -68.32 -32.91 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.392 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.424 HD23 ' CZ2' ' A' ' 44' ' ' TRP . 6.6 tp -62.62 -45.98 90.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.793 0.33 . . . . 0.0 110.587 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.529 ' CD2' ' CD2' ' A' ' 81' ' ' PHE . 9.8 mt -72.95 -30.59 63.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.612 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -82.66 -30.14 29.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.542 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.477 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 1.0 OUTLIER -107.91 9.92 28.61 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.473 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.38 160.22 0.17 Allowed 'General case' 0 C--O 1.232 0.184 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 177.229 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 11.3 p -112.08 138.14 42.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 119.931 1.241 . . . . 0.0 110.158 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.455 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.4 m-85 -116.13 94.73 4.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.524 0.678 . . . . 0.0 110.591 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -149.64 147.64 28.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.422 -179.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.425 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 3.1 p30 -68.77 144.45 95.99 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.388 179.09 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.425 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 56.1 Cg_endo -70.01 127.13 10.57 Favored 'Cis proline' 0 C--N 1.349 0.578 0 C-N-CA 123.536 -1.443 . . . . 0.0 112.361 0.045 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.401 ' N ' ' HA ' ' A' ' 29' ' ' ASP . 18.2 mt -73.58 128.4 35.4 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.817 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.2 p -73.15 140.38 17.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.777 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.7 p -80.04 173.77 12.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.107 0.48 . . . . 0.0 111.856 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.81 -44.38 96.32 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.082 -179.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.32 -36.89 84.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.124 0.488 . . . . 0.0 110.542 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -71.55 -36.49 70.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.343 178.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 5.3 tpt -66.91 -45.0 79.31 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.436 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 77.8 t -55.6 -45.91 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.16 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.026 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -45.45 91.1 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.049 0.452 . . . . 0.0 109.865 178.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.404 ' HA ' ' OD2' ' A' ' 43' ' ' ASP . 36.7 t -55.64 -47.66 78.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.015 179.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.4 t -68.41 -41.69 83.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.799 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -56.24 -47.17 79.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.975 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.532 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 2.8 p30 -71.56 -34.66 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.246 179.539 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.424 ' CZ2' HD23 ' A' ' 21' ' ' LEU . 2.5 m0 -61.76 -46.61 88.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.418 0.627 . . . . 0.0 110.26 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.464 ' HG2' ' N ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -70.91 -36.6 72.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.125 -178.918 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.464 ' N ' ' HG2' ' A' ' 45' ' ' MET . 5.0 t30 -73.6 -39.83 64.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.959 0.409 . . . . 0.0 109.936 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.532 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.88 -45.76 91.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.728 179.438 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.468 ' CE1' ' CZ ' ' A' ' 47' ' ' PHE . 6.8 m-85 -64.71 -46.23 83.19 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.644 179.753 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 3.5 mm -55.18 -55.17 17.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.147 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -68.76 -37.69 79.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.955 0.407 . . . . 0.0 110.921 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.446 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.7 t80 -61.93 -43.07 99.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.91 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.757 ' O ' HG21 ' A' ' 56' ' ' VAL . 24.0 m-85 -75.66 -30.86 59.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.94 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.447 ' HA ' HD13 ' A' ' 67' ' ' LEU . 27.0 ttm105 -61.57 -30.53 70.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.998 0.428 . . . . 0.0 110.411 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -103.49 -10.97 18.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.397 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.466 ' O ' ' HG3' ' A' ' 55' ' ' GLN . 9.5 tp-100 -96.33 21.85 8.53 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.757 HG21 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -102.12 174.06 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.138 0.494 . . . . 0.0 111.638 -179.599 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.0 p -143.8 171.43 14.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.433 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 83.66 -151.74 28.15 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.302 -0.951 . . . . 0.0 113.08 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.472 ' O ' ' HD3' ' A' ' 63' ' ' ARG . 13.8 mm-40 -75.15 159.45 82.5 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-O 120.726 0.298 . . . . 0.0 111.158 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -67.6 -29.06 37.22 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.794 2.329 . . . . 0.0 113.861 -178.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.532 ' HG2' ' N ' ' A' ' 62' ' ' GLU . 8.8 pm0 -66.16 -39.13 89.54 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.945 0.403 . . . . 0.0 111.021 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.532 ' N ' ' HG2' ' A' ' 61' ' ' GLN . 18.3 mt-10 -64.17 -46.68 82.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.19 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.634 ' HD2' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.61 -50.89 68.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.222 0.534 . . . . 0.0 109.611 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -55.46 -41.68 73.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.67 -178.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.418 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 8.5 mttt -61.69 -49.93 74.52 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.477 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.412 ' HA ' ' HG2' ' A' ' 69' ' ' GLU . . . -57.4 -35.84 70.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.857 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 53' ' ' ARG . 6.6 mp -68.78 -37.93 79.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.434 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.443 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 0.0 OUTLIER -70.68 -43.82 68.29 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 179.538 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.443 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 9.1 pt-20 -67.65 -26.55 66.28 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.244 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.406 HD21 HD13 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -69.55 -49.49 53.85 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.443 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.39 -48.84 73.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.785 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.49 -33.88 73.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.164 0.507 . . . . 0.0 109.88 179.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -58.86 -48.23 82.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.656 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.6 mt -67.45 -42.96 82.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.983 0.42 . . . . 0.0 110.341 178.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -52.29 -40.83 62.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.915 -179.136 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.7 m -81.0 -50.7 9.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.156 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.415 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 0.5 OUTLIER -57.0 -34.57 68.27 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.355 -179.07 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.3 -30.09 60.26 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 -178.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.548 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -51.74 -49.74 81.56 Favored Pre-proline 0 CA--C 1.535 0.389 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.237 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.548 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.5 Cg_endo -69.54 -36.63 11.04 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.416 2.077 . . . . 0.0 113.235 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.529 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 13.6 t80 -65.04 -53.63 42.86 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.992 0.425 . . . . 0.0 110.415 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 20.1 mt -58.2 -29.43 65.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.588 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -66.41 -48.87 68.68 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 110.155 179.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -57.21 -49.14 76.93 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.567 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.423 ' CD2' HD22 ' A' ' 89' ' ' LEU . 0.3 OUTLIER -67.74 -33.41 74.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.693 179.854 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.69 -38.07 88.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.163 0.506 . . . . 0.0 109.654 178.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.84 -31.08 64.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.739 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.581 ' CE1' ' ND1' ' A' ' 92' ' ' HIS . 9.1 t80 -73.23 -37.25 66.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.452 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.423 HD22 ' CD2' ' A' ' 85' ' ' TYR . 3.9 mm? -79.25 -44.65 21.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.131 178.69 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 3.0 mmtp -72.23 -36.11 69.02 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -177.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 m -110.47 -28.61 8.45 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -178.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.581 ' ND1' ' CE1' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -84.62 157.89 21.04 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.788 0.804 . . . . 0.0 112.671 -177.861 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.438 ' O ' ' CE1' ' A' ' 92' ' ' HIS . 0.1 OUTLIER -113.15 152.93 29.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.34 -1.3 . . . . 0.0 110.612 179.591 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.968 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.771 0.319 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.98 157.24 5.92 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.773 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 tttm -77.08 -32.95 57.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.336 -179.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.52 -48.4 80.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.795 0.331 . . . . 0.0 111.114 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.34 -52.9 61.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.933 0.397 . . . . 0.0 110.27 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -59.49 -28.27 66.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.734 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -70.63 -45.15 65.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.598 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.401 HD13 ' CG ' ' A' ' 55' ' ' GLN . 0.3 OUTLIER -60.07 -46.18 90.44 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.273 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.412 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 41.1 mm -61.82 -54.28 36.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.079 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.0 t -61.31 -33.07 72.99 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.69 -43.93 75.04 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.945 -179.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.671 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -70.85 -42.3 61.05 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 177.255 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 11' ' ' ILE . 2.1 mt -54.34 -58.7 6.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 113.813 -1.193 . . . . 0.0 109.745 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.7 tttm -61.77 -31.97 72.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.139 0.495 . . . . 0.0 109.851 179.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.49 -48.54 80.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.252 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.48 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -72.82 -50.24 25.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.754 -179.904 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.1 m -55.41 -51.31 67.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.987 0.423 . . . . 0.0 110.173 179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.414 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 95.6 t -65.03 -32.39 58.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.233 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.402 HD23 ' CH2' ' A' ' 44' ' ' TRP . 3.7 tp -64.19 -45.92 86.22 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.612 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.5 HD21 ' CD2' ' A' ' 81' ' ' PHE . 1.7 mt -66.65 -36.01 81.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.008 0.432 . . . . 0.0 110.129 179.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -82.59 -18.18 42.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.188 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.414 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 7.6 mt-30 -107.48 12.24 28.03 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.479 ' HG3' ' CZ ' ' A' ' 81' ' ' PHE . 1.9 mm-40 -50.14 161.97 0.24 Allowed 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 178.003 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.5 t -109.23 132.08 58.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 119.107 0.867 . . . . 0.0 111.102 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.412 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 5.4 m-85 -107.37 131.49 54.19 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.71 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.567 ' O ' ' O ' ' A' ' 30' ' ' PRO . 5.2 m-80 -149.62 147.12 27.75 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.74 -179.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.575 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 2.5 p30 -114.3 125.13 29.65 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 114.997 -1.002 . . . . 0.0 109.92 178.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.575 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 14.0 Cg_endo -56.26 167.82 10.0 Favored 'Cis proline' 0 C--N 1.356 0.925 0 C-N-CA 124.483 -1.049 . . . . 0.0 112.677 0.423 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 28' ' ' ASN . 6.4 mt -110.98 148.38 32.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.335 -179.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.41 ' CG2' ' CB ' ' A' ' 36' ' ' ASP . 10.2 p -73.88 154.23 6.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.84 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.81 170.06 17.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.253 0.549 . . . . 0.0 112.117 -178.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.3 -29.52 68.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.591 -179.2 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -34.06 76.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.077 0.465 . . . . 0.0 110.279 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.41 ' CB ' ' CG2' ' A' ' 32' ' ' VAL . 0.3 OUTLIER -71.7 -40.78 69.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.917 179.232 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.406 ' SD ' ' CD2' ' A' ' 85' ' ' TYR . 0.9 OUTLIER -64.63 -45.59 86.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.754 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.1 t -55.66 -48.16 78.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.875 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -44.86 95.6 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.228 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.418 HG11 ' CD2' ' A' ' 44' ' ' TRP . 53.4 t -59.05 -43.61 89.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.684 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.6 t -67.08 -48.83 77.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.57 179.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -50.86 71.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.381 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.487 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.7 OUTLIER -60.14 -41.64 93.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.168 179.316 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.418 ' CD2' HG11 ' A' ' 40' ' ' VAL . 8.4 m0 -60.75 -43.75 97.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.409 179.372 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -61.54 -50.67 71.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.228 -178.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -68.32 -36.84 79.9 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.487 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.75 -41.15 90.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.783 179.177 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.468 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 4.8 m-85 -70.78 -48.37 54.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.835 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.5 mm -53.86 -55.05 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.302 -179.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -68.65 -34.52 75.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.838 0.352 . . . . 0.0 110.966 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.454 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 3.0 t80 -65.36 -44.34 87.95 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.938 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.671 ' OH ' ' HA2' ' A' ' 14' ' ' GLY . 58.8 m-85 -75.43 -33.39 60.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.59 -179.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 29.7 ttm-85 -61.38 -31.22 71.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.664 0.269 . . . . 0.0 111.476 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -96.2 -9.54 30.24 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.573 ' O ' ' HG3' ' A' ' 55' ' ' GLN . 4.0 pt20 -113.48 35.47 4.01 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -178.602 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -111.75 156.33 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 177.786 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.4 p -122.25 169.84 10.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.82 0.343 . . . . 0.0 110.883 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 91.19 -152.35 21.58 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.505 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.95 163.73 66.19 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 120.765 0.316 . . . . 0.0 110.885 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.44 -27.72 39.58 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.616 2.21 . . . . 0.0 112.547 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -41.91 94.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.96 0.409 . . . . 0.0 110.92 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.77 -46.65 84.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.467 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.467 ' HD3' ' HB ' ' A' ' 56' ' ' VAL . 17.4 mtt85 -55.32 -51.18 67.58 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.255 0.55 . . . . 0.0 109.865 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -55.83 -41.45 74.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.541 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -60.18 -49.9 75.79 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.06 0.457 . . . . 0.0 110.3 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.19 68.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.413 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.5 mp -67.5 -39.98 85.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.401 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -70.29 -45.67 65.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.123 0.487 . . . . 0.0 110.012 179.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.413 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 2.7 mt-10 -62.87 -32.93 74.27 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.239 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.466 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 0.3 OUTLIER -65.97 -49.32 68.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.148 0.499 . . . . 0.0 109.683 179.247 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -55.26 -46.18 76.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.728 -179.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.466 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -69.43 -31.89 70.51 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.089 0.471 . . . . 0.0 110.068 179.09 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.466 ' N ' ' HG3' ' A' ' 72' ' ' GLN . 1.0 OUTLIER -61.82 -45.97 91.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.839 179.584 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.448 ' CD2' ' CE2' ' A' ' 18' ' ' PHE . 1.8 mt -67.36 -44.69 78.39 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 121.157 0.503 . . . . 0.0 110.315 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 26.6 m120 -52.46 -41.2 63.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.855 -179.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.402 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -80.84 -50.56 9.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.037 179.615 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 4.7 mt -56.21 -34.58 66.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.062 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.08 -28.98 61.64 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.55 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 10.6 t30 -53.84 -50.28 84.67 Favored Pre-proline 0 C--N 1.328 -0.333 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.55 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 42.1 Cg_endo -68.29 -39.37 10.16 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.474 2.116 . . . . 0.0 113.222 -179.358 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.5 ' CD2' HD21 ' A' ' 22' ' ' LEU . 5.7 t80 -63.81 -53.53 49.35 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.231 0.538 . . . . 0.0 110.565 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.41 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 88.3 mt -57.57 -31.5 66.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.794 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.456 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -68.3 -45.2 73.66 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.961 0.41 . . . . 0.0 110.772 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -59.62 -41.86 91.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.059 0.457 . . . . 0.0 110.587 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.415 ' O ' ' HG ' ' A' ' 89' ' ' LEU . 0.2 OUTLIER -77.57 -35.71 52.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.691 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 22.3 ptt180 -64.17 -39.49 94.12 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.568 -0.453 . . . . 0.0 109.819 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.59 -36.99 68.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.72 178.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.509 ' O ' ' ND1' ' A' ' 92' ' ' HIS . 4.5 t80 -69.6 -29.24 66.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.486 179.098 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 85' ' ' TYR . 6.2 mt -79.17 -45.26 20.29 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.479 178.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.92 -31.34 72.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.151 -178.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -81.93 5.79 17.94 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.509 ' ND1' ' O ' ' A' ' 88' ' ' PHE . 13.1 m80 -72.04 104.06 3.45 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.676 -179.369 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -51.55 115.57 1.68 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.169 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.901 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.6 tt . . . . . 0 N--CA 1.487 1.39 0 CA-C-O 120.877 0.37 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.0 mt 58.85 162.92 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.983 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.0 mtmt -60.5 -20.11 59.07 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.017 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.15 -45.75 75.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.052 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.48 -50.61 69.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.273 179.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.61 -33.31 71.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.551 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.77 -44.51 89.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.086 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.91 -46.54 89.04 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.226 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.4 ' HA ' ' HE2' ' A' ' 52' ' ' TYR . 35.3 mm -57.79 -53.75 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.821 178.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.506 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 25.1 p -53.0 -42.87 66.02 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.285 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.4 91.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.557 0.218 . . . . 0.0 111.261 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.457 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -69.91 -28.03 72.38 Favored Glycine 0 CA--C 1.518 0.227 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 177.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.434 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.4 OUTLIER -67.35 -61.48 1.89 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.211 -0.994 . . . . 0.0 110.691 179.452 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 12' ' ' SER . 5.1 mmtt -59.69 -39.18 83.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.308 0.575 . . . . 0.0 109.634 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -59.37 -50.64 73.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.956 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.52 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -69.85 -42.7 73.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.985 -179.756 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.46 -51.06 71.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.991 0.424 . . . . 0.0 110.426 179.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.409 ' O ' ' N ' ' A' ' 24' ' ' GLN . 61.1 t -63.29 -33.55 61.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.657 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.436 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 34.9 tp -62.37 -46.14 89.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.826 0.346 . . . . 0.0 110.777 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 36.7 mt -66.25 -41.29 90.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.073 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -80.03 -21.21 43.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.429 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.514 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -117.55 21.48 12.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.223 -179.691 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.653 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.1 OUTLIER -66.93 36.55 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.118 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.653 ' O ' ' O ' ' A' ' 25' ' ' GLN . 22.4 m 8.45 127.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -107.33 100.47 9.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.211 178.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -113.53 148.48 35.99 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.587 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.463 ' HA ' ' N ' ' A' ' 31' ' ' LEU . 0.6 OUTLIER -92.76 148.14 35.45 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.799 179.821 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.02 116.07 4.11 Favored 'Cis proline' 0 C--N 1.349 0.56 0 C-N-CA 123.39 -1.504 . . . . 0.0 112.263 -0.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.463 ' N ' ' HA ' ' A' ' 29' ' ' ASP . 1.0 OUTLIER -38.63 140.12 0.36 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.172 -179.253 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.402 ' CG2' ' CB ' ' A' ' 36' ' ' ASP . 11.1 p -76.46 152.67 5.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.024 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.0 m -79.97 172.19 14.1 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.204 0.526 . . . . 0.0 111.912 -178.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -66.64 -40.74 88.84 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.221 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -37.01 85.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.109 0.48 . . . . 0.0 110.461 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.402 ' CB ' ' CG2' ' A' ' 32' ' ' VAL . 5.0 m-20 -71.91 -35.73 69.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.511 178.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 5.5 tpt -67.16 -45.55 76.7 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.506 178.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 49.1 t -55.67 -46.74 79.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.232 179.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -46.87 85.01 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.162 179.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 25.5 t -55.83 -51.52 59.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.651 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 32.0 t -58.08 -46.42 88.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.544 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.71 -47.09 74.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.466 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.515 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 1.0 OUTLIER -56.83 -48.58 77.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.948 179.833 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.436 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 33.2 m0 -60.76 -42.27 97.12 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.122 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.9 ttp -61.86 -50.96 70.17 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.196 -0.457 . . . . 0.0 112.042 -178.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -72.62 -29.6 63.61 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.515 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 1.1 t80 -64.02 -45.47 88.78 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.832 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -69.49 -42.62 74.53 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.306 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 15.1 mm -54.14 -55.29 15.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.197 -179.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.529 ' HA ' ' HG2' ' A' ' 53' ' ' ARG . 13.0 m-80 -66.64 -34.87 78.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.301 0.572 . . . . 0.0 110.171 179.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.454 ' CE1' ' HG2' ' A' ' 55' ' ' GLN . 6.6 t80 -62.78 -40.22 96.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.044 179.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.457 ' OH ' ' HA2' ' A' ' 14' ' ' GLY . 5.3 m-85 -75.47 -38.71 59.43 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -178.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.529 ' HG2' ' HA ' ' A' ' 50' ' ' ASN . 4.8 ptp85 -58.75 -31.64 68.52 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.122 -179.393 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -91.49 -11.38 37.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.591 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.454 ' HG2' ' CE1' ' A' ' 51' ' ' TYR . 2.5 mp0 -96.58 -18.62 19.64 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.134 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.578 ' HB ' ' HG3' ' A' ' 63' ' ' ARG . 14.5 t -68.78 160.39 4.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.08 0.467 . . . . 0.0 111.886 -179.257 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.4 p -133.88 171.11 14.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.509 179.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 90.9 -151.08 20.95 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.934 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.11 162.91 65.25 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.707 0.289 . . . . 0.0 110.984 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -60.98 -28.34 86.14 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.715 2.277 . . . . 0.0 112.761 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -43.29 99.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.131 0.491 . . . . 0.0 110.679 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.23 -46.66 88.99 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.211 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.578 ' HG3' ' HB ' ' A' ' 56' ' ' VAL . 3.7 mpt_? -54.04 -51.19 64.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.05 0.452 . . . . 0.0 110.014 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.43 -41.97 73.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.314 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.405 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 2.2 ttmm -66.66 -32.06 73.14 Favored 'General case' 0 CA--C 1.523 -0.069 0 O-C-N 122.082 -0.386 . . . . 0.0 110.852 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -71.07 -38.33 72.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.464 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.432 HD13 ' CA ' ' A' ' 53' ' ' ARG . 8.9 mp -70.03 -35.05 74.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.588 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 3.3 pp0? -73.81 -46.35 45.81 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.373 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -62.34 -35.65 79.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.522 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.432 HD22 ' CD1' ' A' ' 52' ' ' TYR . 2.1 tp -66.09 -49.02 69.02 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.111 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -55.23 -45.65 75.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.796 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.04 -33.53 65.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.041 0.448 . . . . 0.0 110.056 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.77 -48.0 83.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.752 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.5 mt -67.67 -44.8 76.96 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.931 0.396 . . . . 0.0 110.535 178.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -52.69 -40.17 62.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.326 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.1 t -80.87 -34.73 33.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.265 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.427 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 0.6 OUTLIER -72.97 -30.16 63.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.996 -179.276 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.26 -29.4 60.16 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.551 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 15.3 m-20 -54.76 -50.23 87.06 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.551 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.2 Cg_endo -69.78 -37.87 8.52 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.459 2.106 . . . . 0.0 112.74 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.493 ' CD2' ' CD2' ' A' ' 22' ' ' LEU . 1.8 t80 -62.75 -53.42 54.58 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 110.415 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 93.2 mt -55.03 -27.64 46.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.283 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.47 -45.46 62.49 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.457 179.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -56.86 -42.94 80.65 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.146 0.498 . . . . 0.0 109.925 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.34 -33.39 61.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.445 179.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -44.49 96.28 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.461 ' HA ' ' HG2' ' A' ' 90' ' ' LYS . 1.0 OUTLIER -71.24 -33.55 69.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.007 178.99 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.415 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 2.9 t80 -71.49 -28.91 64.24 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.017 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -78.68 -45.36 21.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.421 179.287 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.461 ' HG2' ' HA ' ' A' ' 87' ' ' ASP . 11.4 pttp -73.83 -37.93 64.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.216 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.4 t -75.22 -11.29 60.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.525 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.442 ' CE1' ' CD1' ' A' ' 31' ' ' LEU . 2.3 m170 -66.94 105.05 1.51 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.985 0.422 . . . . 0.0 110.98 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -121.62 111.97 17.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.264 178.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mt . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.299 -0.857 . . . . 0.0 110.937 -179.948 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pp . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 120.736 0.303 . . . . 0.0 111.252 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.5 mt -145.44 101.72 3.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.114 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -55.02 -30.0 58.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.133 0.492 . . . . 0.0 110.534 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.22 -44.97 75.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.796 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -64.07 -50.88 66.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.179 179.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -34.48 71.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.568 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -65.15 -42.63 93.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.155 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.555 ' CD1' ' CD2' ' A' ' 52' ' ' TYR . 0.2 OUTLIER -59.72 -48.22 82.53 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.717 179.324 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 41.0 mm -59.13 -53.79 43.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.073 178.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 72.3 m -57.21 -33.11 67.18 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.011 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.17 91.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.183 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.499 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -69.75 -41.87 72.7 Favored Glycine 0 CA--C 1.511 -0.201 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 177.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.4 -58.9 5.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 113.824 -1.188 . . . . 0.0 109.624 178.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -30.92 69.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.373 179.465 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.33 -47.26 74.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.449 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.538 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -71.32 -46.11 61.42 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.71 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 82.9 p -55.51 -51.6 66.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 0.0 110.749 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 48.3 t -66.59 -33.27 62.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.967 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.446 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 2.6 tp -66.76 -45.78 77.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.01 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.564 HD21 ' CD2' ' A' ' 81' ' ' PHE . 4.5 mt -68.23 -35.11 77.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.855 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.47 -34.24 31.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.91 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -104.8 18.81 21.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.233 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.49 ' O ' ' CB ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -39.37 -59.37 1.08 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.762 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.49 ' CB ' ' O ' ' A' ' 25' ' ' GLN . 42.4 t 98.92 130.19 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.534 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.448 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.1 m-85 -122.19 96.18 4.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.979 -179.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -143.71 137.65 28.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.02 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.94 144.13 68.94 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.839 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.84 126.79 12.2 Favored 'Cis proline' 0 C--N 1.349 0.571 0 C-N-CA 123.432 -1.487 . . . . 0.0 112.349 0.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.9 mt -70.74 123.79 22.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.114 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 11.6 p -74.55 144.92 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.825 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.86 173.36 12.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.085 0.469 . . . . 0.0 111.734 -178.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.61 -42.81 95.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.141 -179.121 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -66.07 -37.25 85.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.071 0.462 . . . . 0.0 110.756 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -71.57 -37.84 71.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.819 179.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 1.4 tpt -67.91 -45.14 75.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.704 178.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 96.1 t -56.41 -44.14 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.448 179.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -45.57 92.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.924 0.392 . . . . 0.0 110.142 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 39.2 t -60.11 -44.23 94.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.533 179.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.44 HG23 ' CE2' ' A' ' 81' ' ' PHE . 38.8 t -65.06 -49.11 81.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.62 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.83 -42.94 80.54 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.237 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.26 -41.0 92.33 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.071 0.462 . . . . 0.0 109.774 179.022 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.446 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 10.7 m0 -60.52 -39.35 87.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.249 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.45 ' HA ' ' CD1' ' A' ' 74' ' ' LEU . 52.0 mtm -68.07 -45.99 72.3 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -178.579 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -34.35 73.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.03 0.443 . . . . 0.0 110.07 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.449 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -62.8 -46.19 89.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.098 179.32 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -66.61 -47.39 72.79 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.12 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -55.31 -55.09 18.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.027 -179.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.466 ' HA ' ' HG2' ' A' ' 53' ' ' ARG . 8.0 m-80 -66.68 -36.85 83.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.131 0.491 . . . . 0.0 110.727 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.449 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 4.7 t80 -64.65 -39.27 93.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.142 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.555 ' CD2' ' CD1' ' A' ' 10' ' ' LEU . 7.5 m-85 -75.64 -36.75 60.1 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.466 ' HG2' ' HA ' ' A' ' 50' ' ' ASN . 8.8 ptp180 -58.13 -28.48 64.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.089 0.471 . . . . 0.0 110.8 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -95.49 -8.57 34.91 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.596 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -95.7 -7.83 36.3 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.58 ' HB ' ' HD2' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -85.14 178.29 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.172 0.511 . . . . 0.0 111.715 -178.962 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.0 p -144.91 171.4 14.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.288 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.85 -144.85 19.72 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.901 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -79.17 163.69 58.48 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.724 0.297 . . . . 0.0 110.975 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.415 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 45.4 Cg_endo -67.7 -22.74 43.22 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.666 2.244 . . . . 0.0 112.777 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.17 -43.13 92.71 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.938 0.399 . . . . 0.0 110.733 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -60.82 -44.58 96.73 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.081 179.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.58 ' HD2' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.52 -50.96 68.6 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.225 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -55.28 -41.94 72.95 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.535 -178.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.436 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 0.8 OUTLIER -66.33 -34.41 77.93 Favored 'General case' 0 C--O 1.231 0.101 0 O-C-N 122.103 -0.373 . . . . 0.0 110.955 -179.819 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.468 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -69.48 -38.48 77.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.089 0.471 . . . . 0.0 110.032 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.442 HD13 ' CA ' ' A' ' 53' ' ' ARG . 8.1 mp -68.45 -35.94 78.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.395 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 6.0 pt20 -76.08 -48.91 19.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.811 0.338 . . . . 0.0 110.815 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.421 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.2 mt-10 -61.98 -41.98 98.63 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.519 -179.543 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.468 ' HB2' ' O ' ' A' ' 66' ' ' ALA . 9.5 tp -66.68 -49.1 67.2 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.73 -43.27 76.44 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.431 179.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.4 -41.25 76.67 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.158 0.504 . . . . 0.0 109.65 179.111 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -58.55 -39.41 80.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.601 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.45 ' CD1' ' HA ' ' A' ' 45' ' ' MET . 1.3 mt -67.98 -45.53 73.91 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.202 0.525 . . . . 0.0 109.813 178.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -52.52 -37.19 56.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.563 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.425 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -80.83 -50.6 9.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.69 179.148 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.403 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 3.8 mt -57.81 -35.02 70.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.506 -178.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.16 -30.89 60.86 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.546 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.0 OUTLIER -51.52 -49.97 79.48 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.086 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.546 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 51.1 Cg_endo -69.4 -34.1 16.52 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.43 2.087 . . . . 0.0 112.961 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.564 ' CD2' HD21 ' A' ' 22' ' ' LEU . 3.3 t80 -66.97 -53.85 27.64 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.902 0.382 . . . . 0.0 110.22 179.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 90.6 mt -60.6 -27.57 67.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.783 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.508 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -70.25 -42.67 71.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.051 0.453 . . . . 0.0 110.465 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.69 -42.9 94.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.299 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -72.66 -42.71 64.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.519 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.508 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 9.1 ptm180 -59.84 -35.4 74.67 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.449 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.497 ' HA ' ' HG2' ' A' ' 90' ' ' LYS . 0.1 OUTLIER -72.55 -35.32 67.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.343 178.141 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -69.89 -28.55 65.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.004 179.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.24 -45.52 22.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.141 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.497 ' HG2' ' HA ' ' A' ' 87' ' ' ASP . 17.3 ptpt -72.83 -35.54 67.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.968 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.412 ' N ' ' HG3' ' A' ' 90' ' ' LYS . 68.2 m -86.71 -6.86 58.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.487 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 110.18 0.96 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.903 0.382 . . . . 0.0 110.856 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -121.24 109.96 15.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.354 178.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.145 -0.931 . . . . 0.0 110.906 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.451 ' CD1' ' N ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 120.824 0.345 . . . . 0.0 111.353 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.57 -32.15 25.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.126 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.67 -33.2 54.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.94 0.4 . . . . 0.0 110.82 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.37 -45.51 93.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.718 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -64.71 -45.82 84.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.49 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.44 -34.38 78.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.713 179.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.92 -45.0 83.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.48 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.7 tp -60.81 -46.09 91.88 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.211 0.529 . . . . 0.0 109.691 179.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 mt -60.48 -53.81 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.962 178.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.404 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 4.1 m -55.2 -33.65 63.22 Favored 'General case' 0 C--O 1.227 -0.107 0 CA-C-O 120.912 0.387 . . . . 0.0 110.468 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.06 -41.34 95.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.588 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.463 ' HA2' ' OH ' ' A' ' 52' ' ' TYR . . . -70.39 -40.41 69.09 Favored Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 109.126 -1.59 . . . . 0.0 109.126 176.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.404 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.3 OUTLIER -54.64 -60.02 3.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.908 -1.146 . . . . 0.0 110.454 179.135 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.7 tttm -60.8 -34.65 74.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.164 0.507 . . . . 0.0 110.092 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.44 -47.76 84.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.214 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.55 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -69.81 -50.31 44.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.852 -179.76 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 61.6 m -55.44 -51.6 66.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.05 0.452 . . . . 0.0 110.836 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.3 t -63.66 -33.76 63.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.646 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.438 ' CD2' ' CZ3' ' A' ' 44' ' ' TRP . 1.0 OUTLIER -66.24 -45.95 78.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.647 179.878 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 2.6 mt -61.93 -37.75 85.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.015 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -82.52 -19.29 38.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.034 179.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.451 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -109.58 21.28 17.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.425 -179.683 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.801 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.8 OUTLIER -74.31 29.45 0.08 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.295 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.801 ' O ' ' O ' ' A' ' 25' ' ' GLN . 22.9 t 19.78 133.31 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 N-CA-C 113.815 1.042 . . . . 0.0 113.815 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -114.04 95.85 5.51 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.245 0.545 . . . . 0.0 110.804 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -142.42 142.76 32.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.761 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.561 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 2.4 m-20 -78.2 159.06 76.2 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.867 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.561 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 20.3 Cg_endo -60.65 139.42 24.04 Favored 'Cis proline' 0 C--N 1.352 0.747 0 C-N-CA 123.625 -1.406 . . . . 0.0 112.229 -0.045 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.449 ' CD1' ' CD2' ' A' ' 92' ' ' HIS . 9.8 mt -76.7 123.69 26.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.116 -179.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 11.5 p -74.82 148.04 8.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.86 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.8 m -79.88 172.46 13.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.073 0.463 . . . . 0.0 111.671 -178.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.407 ' HB3' ' CD2' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -70.32 -29.34 66.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.355 -179.442 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.56 -36.57 78.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.983 0.42 . . . . 0.0 110.436 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.11 -36.68 64.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.912 -0.586 . . . . 0.0 109.703 178.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.412 ' HG2' ' CD2' ' A' ' 85' ' ' TYR . 2.5 tpt -67.74 -47.29 69.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.615 178.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 92.3 t -56.27 -46.06 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.167 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -58.36 -47.15 84.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.137 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 42.6 t -59.0 -40.92 81.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.759 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 20.3 t -67.32 -48.88 76.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.696 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.96 -46.27 78.63 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.529 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.495 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -64.39 -41.14 96.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.55 179.542 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.438 ' CZ3' ' CD2' ' A' ' 21' ' ' LEU . 7.5 m0 -60.83 -42.88 98.6 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.777 179.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 4.6 ttp -68.17 -43.53 78.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.299 -178.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -72.42 -34.05 67.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.896 0.379 . . . . 0.0 110.054 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.495 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.03 -43.81 97.67 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.116 179.441 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -69.09 -45.72 69.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.334 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.603 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 2.0 mm -55.25 -55.7 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.364 -179.273 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.428 ' HA ' ' HD2' ' A' ' 53' ' ' ARG . 20.8 m-80 -65.5 -36.28 83.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.145 0.498 . . . . 0.0 110.731 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.513 ' CD1' ' HG3' ' A' ' 55' ' ' GLN . 0.7 OUTLIER -62.19 -45.61 92.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.517 -179.497 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.463 ' OH ' ' HA2' ' A' ' 14' ' ' GLY . 17.3 m-85 -76.01 -33.46 59.68 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -178.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.603 ' HG3' ' O ' ' A' ' 49' ' ' ILE . 0.8 OUTLIER -63.53 -24.99 68.05 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 119.849 -0.741 . . . . 0.0 110.755 -179.697 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -98.79 -16.01 19.07 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.513 ' HG3' ' CD1' ' A' ' 51' ' ' TYR . 7.0 mm-40 -102.09 45.85 0.95 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.57 ' HB ' ' CD ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -125.0 173.54 10.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.173 0.511 . . . . 0.0 111.496 179.353 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.435 ' O ' ' NE ' ' A' ' 63' ' ' ARG . 12.1 p -144.17 171.16 14.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.183 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.49 -155.52 30.97 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.2 -1.0 . . . . 0.0 112.891 179.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.46 ' O ' ' NE ' ' A' ' 63' ' ' ARG . 1.4 mt-10 -67.9 144.76 97.5 Favored Pre-proline 0 C--N 1.333 -0.15 0 CA-C-O 120.755 0.312 . . . . 0.0 111.221 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.404 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 42.3 Cg_endo -67.45 -25.64 41.46 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.784 2.323 . . . . 0.0 113.084 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.56 -43.89 95.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.13 0.49 . . . . 0.0 110.886 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.419 ' HB2' ' NH2' ' A' ' 63' ' ' ARG . 1.8 mt-10 -60.71 -43.36 97.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.045 179.344 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.608 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -55.26 -51.39 66.79 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.298 0.57 . . . . 0.0 109.605 179.219 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.33 -41.49 72.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.705 -178.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.407 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 0.2 OUTLIER -63.25 -49.78 72.76 Favored 'General case' 0 CA--C 1.523 -0.081 0 C-N-CA 119.941 -0.704 . . . . 0.0 110.328 179.888 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.94 -40.91 90.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.307 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.608 HD12 ' O ' ' A' ' 63' ' ' ARG . 2.4 mp -61.96 -45.89 91.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.459 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.478 ' O ' ' HG2' ' A' ' 71' ' ' ARG . 2.2 pp0? -66.72 -38.23 86.27 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.189 0.519 . . . . 0.0 110.06 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.89 -30.89 71.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.545 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.9 mt -71.02 -49.84 40.62 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.141 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 6.7 ptt85 -56.4 -40.26 74.35 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.444 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 1.1 mt-30 -72.9 -35.91 67.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.227 0.537 . . . . 0.0 109.555 178.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -45.48 94.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.093 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.416 HD21 ' CE2' ' A' ' 18' ' ' PHE . 11.5 mt -67.87 -45.08 75.53 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.121 0.486 . . . . 0.0 110.329 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.7 -38.17 60.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.756 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.402 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 2.6 p -80.86 -50.7 9.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.137 0.494 . . . . 0.0 110.624 179.212 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.404 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 4.4 mt -56.59 -33.01 65.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.148 -179.196 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.19 -31.02 60.83 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.544 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.4 OUTLIER -51.85 -50.23 79.14 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.228 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.544 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 52.5 Cg_endo -69.73 -33.98 15.6 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.522 2.148 . . . . 0.0 113.177 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.519 ' CD2' HD21 ' A' ' 22' ' ' LEU . 2.2 t80 -66.15 -53.56 36.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.982 0.42 . . . . 0.0 110.505 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.8 mt -58.31 -29.02 65.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.796 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.9 -47.94 60.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.87 0.367 . . . . 0.0 110.475 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -41.42 84.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.527 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.412 ' CD2' ' HG2' ' A' ' 37' ' ' MET . 0.3 OUTLIER -76.19 -33.41 59.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.759 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 mmt-85 -67.11 -40.5 86.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.045 0.45 . . . . 0.0 110.098 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.66 -36.89 68.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.926 179.057 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.566 ' O ' ' HB3' ' A' ' 92' ' ' HIS . 26.4 t80 -72.46 -28.78 63.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.676 179.15 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.421 ' HA ' ' CE1' ' A' ' 92' ' ' HIS . 2.2 mp -71.95 -45.62 60.41 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.64 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -72.83 -31.16 64.59 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.735 -1.12 . . . . 0.0 112.085 -179.273 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.28 -14.15 20.41 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.777 1.028 . . . . 0.0 113.777 -177.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.566 ' HB3' ' O ' ' A' ' 88' ' ' PHE . 0.8 OUTLIER -89.7 128.88 36.17 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.566 179.608 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -121.04 142.16 50.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.49 178.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 12.2 mt . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.139 -179.883 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 mtpt . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.639 0.257 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.61 -44.45 82.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.196 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.2 tp -60.04 -45.1 93.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.783 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.538 HG22 HD23 ' A' ' 15' ' ' LEU . 43.6 mm -60.49 -54.23 38.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.878 179.14 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.8 m -51.92 -33.06 35.49 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.869 0.366 . . . . 0.0 110.697 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.76 -44.42 77.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.241 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.466 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.2 -28.22 72.97 Favored Glycine 0 N--CA 1.451 -0.365 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 177.39 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.538 HD23 HG22 ' A' ' 11' ' ' ILE . 1.7 mm? -70.08 -61.37 1.8 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.52 -0.84 . . . . 0.0 110.253 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.659 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.8 ttpm? -59.3 -36.07 74.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.985 0.421 . . . . 0.0 110.086 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -60.58 -49.39 77.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.275 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.505 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -71.26 -49.31 44.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.391 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.609 ' HA ' HD12 ' A' ' 22' ' ' LEU . 1.3 m -55.36 -51.55 66.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.966 0.413 . . . . 0.0 110.802 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.659 HG23 ' O ' ' A' ' 16' ' ' LYS . 46.3 t -66.45 -34.95 73.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.065 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.864 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 0.5 OUTLIER -65.88 -46.21 79.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.641 0.258 . . . . 0.0 111.199 -179.741 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.66 HD23 ' CD2' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -64.38 -40.91 96.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.951 0.405 . . . . 0.0 110.358 179.857 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -82.78 -17.25 44.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.149 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.451 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 0.9 OUTLIER -105.35 6.98 33.13 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.851 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -50.77 162.23 0.28 Allowed 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 177.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.7 p -108.24 133.87 51.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 119.322 0.965 . . . . 0.0 110.868 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.454 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.6 m-85 . . . . . 0 C--N 1.327 -0.378 0 CA-C-O 121.312 0.577 . . . . 0.0 110.937 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.56 HD23 ' CE2' ' A' ' 88' ' ' PHE . 3.6 mp . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 120.9 0.381 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.864 HG22 ' HB3' ' A' ' 36' ' ' ASP . 1.9 p -78.0 146.31 8.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.598 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.1 m -79.76 172.45 13.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.19 0.519 . . . . 0.0 111.809 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.904 ' O ' HG23 ' A' ' 38' ' ' VAL . 3.1 tt0 -64.63 -44.4 90.62 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.841 -178.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -34.49 77.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.185 0.517 . . . . 0.0 110.514 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.873 ' O ' HG23 ' A' ' 40' ' ' VAL . 9.2 t70 -72.22 -38.18 69.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.021 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.889 ' O ' HG23 ' A' ' 41' ' ' VAL . 2.0 tpt -67.81 -43.05 80.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.671 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 34' ' ' GLU . 46.5 t -57.97 -47.27 87.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.479 179.236 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -59.59 -46.98 87.35 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.858 0.361 . . . . 0.0 110.092 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.873 HG23 ' O ' ' A' ' 36' ' ' ASP . 40.6 t -58.75 -45.06 91.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.515 179.333 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.889 HG23 ' O ' ' A' ' 37' ' ' MET . 40.1 t -61.9 -48.57 87.96 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.383 179.356 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -58.27 -46.42 86.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.312 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.6 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -57.99 -45.6 86.53 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.076 179.175 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.864 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 10.9 m0 -60.21 -39.54 86.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.217 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.746 ' HG3' HD12 ' A' ' 74' ' ' LEU . 27.4 ttm -71.2 -43.95 66.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.784 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -73.66 -36.45 65.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.984 0.421 . . . . 0.0 110.022 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.6 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.22 -44.59 94.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.053 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -69.77 -43.67 71.7 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.944 0.402 . . . . 0.0 110.459 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.478 ' O ' ' CG ' ' A' ' 53' ' ' ARG . 9.8 mm -54.66 -55.72 14.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.47 ' HA ' ' HG3' ' A' ' 53' ' ' ARG . 11.3 t30 -62.07 -36.63 82.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.337 0.589 . . . . 0.0 110.373 179.316 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.521 ' HB2' ' O ' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -57.75 -48.53 79.36 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.332 179.72 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.575 ' O ' HG22 ' A' ' 56' ' ' VAL . 23.1 m-85 -75.63 -30.36 59.47 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.48 ' HG2' ' HG ' ' A' ' 67' ' ' LEU . 0.1 OUTLIER -62.77 -28.06 69.72 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.146 179.278 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -97.11 -15.8 20.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.02 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.475 ' HG3' ' CD1' ' A' ' 51' ' ' TYR . 12.2 mm-40 -102.71 45.19 0.97 Allowed 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.718 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.678 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -120.83 163.73 18.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.028 0.442 . . . . 0.0 111.144 179.22 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.02 171.6 14.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.565 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 81.19 -156.06 37.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.264 -0.969 . . . . 0.0 113.06 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -68.69 156.96 89.82 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.851 0.358 . . . . 0.0 111.235 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.434 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 43.8 Cg_endo -67.85 -23.34 41.52 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.674 2.249 . . . . 0.0 112.9 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -65.05 -44.07 90.22 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.84 0.352 . . . . 0.0 111.461 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -64.54 -42.77 95.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.079 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.678 ' HA ' HG11 ' A' ' 56' ' ' VAL . 15.8 mtt180 -53.77 -52.34 60.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -57.04 -42.18 80.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.866 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.41 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 0.1 OUTLIER -62.6 -31.86 72.76 Favored 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.55 179.909 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.438 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -72.82 -40.8 65.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.493 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.594 HD13 ' O ' ' A' ' 63' ' ' ARG . 0.6 OUTLIER -70.5 -35.87 73.47 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.556 -179.59 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.423 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 15.5 pt20 -72.82 -47.62 44.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.995 0.426 . . . . 0.0 110.272 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.464 ' O ' ' HB2' ' A' ' 73' ' ' GLU . 12.3 mt-10 -61.96 -36.57 81.84 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.271 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 66' ' ' ALA . 0.2 OUTLIER -64.71 -48.41 74.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.722 0.296 . . . . 0.0 110.253 179.087 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.7 ttt-85 -54.55 -43.45 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -31.78 65.09 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.149 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 4.3 tp10 -62.46 -49.48 75.27 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.128 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.746 HD12 ' HG3' ' A' ' 45' ' ' MET . 14.0 mt -67.87 -44.7 76.45 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.053 0.454 . . . . 0.0 110.524 178.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.38 -39.65 61.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.694 -179.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.426 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 27.7 m -80.91 -50.67 9.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.737 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.418 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 1.1 mt -55.8 -33.99 64.9 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.152 -179.185 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.85 -30.93 61.51 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.3 0.481 . . . . 0.0 112.3 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.558 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 4.8 m-20 -51.72 -50.24 78.62 Favored Pre-proline 0 C--N 1.328 -0.326 0 N-CA-C 111.811 0.301 . . . . 0.0 111.811 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.558 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 51.3 Cg_endo -69.65 -36.24 11.47 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.444 2.096 . . . . 0.0 113.092 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.66 ' CD2' HD23 ' A' ' 22' ' ' LEU . 3.4 t80 -62.99 -53.79 48.38 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.044 0.449 . . . . 0.0 110.514 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 59.6 mt -54.96 -31.85 60.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.769 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.81 -44.78 72.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.394 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 80' ' ' PRO . 6.0 mttm -57.39 -43.33 83.55 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.077 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.492 ' OH ' HG12 ' A' ' 32' ' ' VAL . 1.2 t80 -74.14 -33.53 63.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.997 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -45.71 93.65 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.08 -33.0 71.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.623 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.56 ' CE2' HD23 ' A' ' 31' ' ' LEU . 30.5 t80 -67.42 -29.06 68.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.173 179.066 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.5 HD13 ' HA ' ' A' ' 89' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.613 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.703 ' HA ' HD12 ' A' ' 11' ' ' ILE . 5.3 tttp . . . . . 0 N--CA 1.456 -0.139 0 CA-C-O 120.642 0.258 . . . . 0.0 111.086 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.88 -44.51 92.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.836 0.35 . . . . 0.0 110.268 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.731 HD11 ' HG3' ' A' ' 55' ' ' GLN . 4.3 tp -61.01 -45.79 93.36 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.144 0.497 . . . . 0.0 109.837 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.703 HD12 ' HA ' ' A' ' 8' ' ' LYS . 11.9 mt -60.39 -53.68 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.013 179.08 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.2 p -54.31 -33.05 57.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.64 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.89 -41.45 82.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.75 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.498 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -70.24 -42.48 66.24 Favored Glycine 0 C--O 1.227 -0.316 0 N-CA-C 109.113 -1.595 . . . . 0.0 109.113 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.493 HD23 HG22 ' A' ' 11' ' ' ILE . 1.7 mm? -54.41 -58.27 8.08 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 113.822 -1.189 . . . . 0.0 109.221 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.461 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -60.38 -29.43 68.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.503 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.461 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -68.82 -46.44 68.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.437 179.616 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.579 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -71.83 -46.43 58.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.821 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 79.0 p -55.43 -51.52 66.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.02 0.438 . . . . 0.0 110.366 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.426 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 77.5 t -67.16 -31.11 51.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.564 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.898 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 18.0 tp -64.27 -46.38 83.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.895 0.379 . . . . 0.0 110.237 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.784 HD22 ' HB2' ' A' ' 81' ' ' PHE . 9.4 mt -66.26 -36.61 83.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.256 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.61 -17.41 44.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.386 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.426 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 0.4 OUTLIER -111.81 6.46 19.67 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -179.066 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.522 HE22 HD23 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -48.56 162.59 0.09 Allowed 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 177.594 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 23.5 t -110.66 134.33 53.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 119.592 1.087 . . . . 0.0 110.23 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.42 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 13.4 m-85 . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 121.652 0.739 . . . . 0.0 110.916 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.499 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.4 mp . . . . . 0 C--O 1.231 0.082 0 CA-C-O 121.193 0.52 . . . . 0.0 111.967 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.437 HG12 ' OH ' ' A' ' 85' ' ' TYR . 9.9 p -77.69 155.98 5.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.729 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.416 ' N ' HG22 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -79.85 171.7 14.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.124 0.488 . . . . 0.0 111.725 -178.612 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.93 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -71.05 -31.68 68.19 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.648 -179.271 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -67.07 -37.01 83.25 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.238 0.542 . . . . 0.0 110.182 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.901 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.4 OUTLIER -72.65 -34.71 67.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.465 178.686 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.723 ' O ' HG23 ' A' ' 41' ' ' VAL . 2.6 tpt -67.78 -46.1 72.98 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.45 178.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.93 HG23 ' O ' ' A' ' 34' ' ' GLU . 59.8 t -55.83 -47.99 78.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.303 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.401 HG22 ' O ' ' A' ' 36' ' ' ASP . 0.5 OUTLIER -58.06 -46.72 84.95 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.896 0.379 . . . . 0.0 110.027 179.362 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.901 HG23 ' O ' ' A' ' 36' ' ' ASP . 46.8 t -57.22 -47.5 84.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.577 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.723 HG23 ' O ' ' A' ' 37' ' ' MET . 32.8 t -61.37 -47.97 91.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.554 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -56.36 -48.53 76.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.505 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.591 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 1.8 m-20 -60.04 -45.07 94.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.681 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.898 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 13.1 m0 -60.72 -42.48 97.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.087 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 39.8 mtm -66.63 -48.74 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -178.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -70.48 -32.84 70.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.977 0.418 . . . . 0.0 110.063 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.591 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -62.75 -42.6 99.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.043 179.338 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.472 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 6.3 m-85 -69.82 -44.81 69.22 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.335 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.458 HD12 ' HA ' ' A' ' 49' ' ' ILE . 0.3 OUTLIER -57.34 -55.29 21.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.937 0.399 . . . . 0.0 110.758 -179.874 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -66.4 -41.19 89.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.906 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.492 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 5.0 t80 -60.43 -46.0 91.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.367 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.569 ' O ' HG22 ' A' ' 56' ' ' VAL . 25.9 m-85 -70.19 -31.29 68.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.738 -0.664 . . . . 0.0 112.184 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.911 ' HB2' HD21 ' A' ' 67' ' ' LEU . 34.5 ttm-85 -59.12 -27.96 66.09 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.684 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -94.99 -17.93 21.51 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.731 ' HG3' HD11 ' A' ' 10' ' ' LEU . 5.5 pt20 -105.54 45.13 0.98 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.297 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -124.1 163.5 23.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.525 178.792 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.4 m -127.07 166.45 17.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.441 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 91.6 -149.79 19.99 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.715 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -80.63 157.02 72.73 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.804 0.335 . . . . 0.0 111.005 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.435 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 42.6 Cg_endo -67.72 -19.75 47.11 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.874 2.383 . . . . 0.0 113.479 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -66.2 -43.98 85.21 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.891 0.376 . . . . 0.0 111.446 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -66.7 -35.43 80.11 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.181 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.532 ' HG3' ' HB ' ' A' ' 56' ' ' VAL . 2.2 mpt_? -59.48 -50.96 71.91 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -58.44 -41.64 85.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.548 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -49.67 73.9 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.262 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.486 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.13 -33.76 67.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.269 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.911 HD21 ' HB2' ' A' ' 53' ' ' ARG . 4.2 mp -69.68 -34.28 73.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.279 179.073 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.539 ' HA ' ' HG2' ' A' ' 71' ' ' ARG . 0.8 OUTLIER -74.43 -48.75 25.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.559 179.506 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.443 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 7.2 mm-40 -63.28 -30.34 71.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.875 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.501 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 1.4 tp -73.65 -48.4 32.65 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.686 -0.406 . . . . 0.0 109.945 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.539 ' HG2' ' HA ' ' A' ' 68' ' ' GLN . 6.7 ptp180 -56.88 -38.48 72.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.441 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.514 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 3.1 pt20 -75.03 -36.0 61.9 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.287 0.565 . . . . 0.0 109.51 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.473 ' OE2' HD11 ' A' ' 15' ' ' LEU . 4.1 mm-40 -62.63 -42.17 99.43 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.397 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.574 HD23 ' CD2' ' A' ' 18' ' ' PHE . 37.6 mt -67.86 -45.21 75.22 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.126 0.489 . . . . 0.0 110.009 178.356 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -53.78 -38.65 64.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.137 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.7 -34.53 34.54 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.059 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.426 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 3.4 mt -74.5 -28.15 60.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.046 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.08 -29.82 60.77 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.569 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.1 m120 -54.69 -50.19 87.12 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.461 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 45.1 Cg_endo -68.74 -37.04 12.75 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.403 2.069 . . . . 0.0 112.81 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.784 ' HB2' HD22 ' A' ' 22' ' ' LEU . 1.5 t80 -63.94 -52.61 58.96 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.087 0.47 . . . . 0.0 110.254 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 60.0 mt -57.04 -28.13 62.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.721 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.97 -46.73 61.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.905 0.383 . . . . 0.0 110.369 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.9 mmmt -57.09 -43.09 81.86 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.296 179.311 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.518 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.3 OUTLIER -76.05 -33.32 59.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.62 179.551 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 40.8 mtt180 -64.87 -42.37 94.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.065 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.59 -34.32 67.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.268 0.556 . . . . 0.0 109.73 178.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.499 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 6.9 t80 -71.04 -28.71 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.627 179.159 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.679 HD23 ' HG3' ' A' ' 34' ' ' GLU . 4.2 mp . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.083 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.877 ' HA ' HD12 ' A' ' 11' ' ' ILE . 1.6 pttm . . . . . 0 N--CA 1.456 -0.162 0 CA-C-O 120.705 0.288 . . . . 0.0 110.736 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.94 -44.57 89.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.343 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.486 HD22 ' O ' ' A' ' 55' ' ' GLN . 1.7 tp -61.99 -43.79 98.1 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.877 HD12 ' HA ' ' A' ' 8' ' ' LYS . 7.6 mt -61.35 -54.36 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.504 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -55.45 -43.05 75.07 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.424 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.488 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -58.86 -43.36 90.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.851 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.687 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.83 -28.32 72.11 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 177.119 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.504 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.3 OUTLIER -65.41 -61.33 2.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.095 -1.053 . . . . 0.0 110.322 179.053 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.637 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.1 mtpt -58.0 -38.46 76.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.203 0.525 . . . . 0.0 109.932 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.6 tt0 -56.57 -49.57 74.46 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.279 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.665 ' CE2' HD23 ' A' ' 74' ' ' LEU . 0.7 OUTLIER -71.41 -50.58 30.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.553 -179.481 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -51.75 67.0 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.05 0.452 . . . . 0.0 110.776 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.637 HG23 ' O ' ' A' ' 16' ' ' LYS . 48.9 t -64.19 -35.64 74.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.625 179.566 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.928 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 0.3 OUTLIER -66.27 -45.87 79.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.688 0.28 . . . . 0.0 110.911 -179.855 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.738 HD22 ' CG ' ' A' ' 81' ' ' PHE . 11.1 mt -60.43 -40.26 90.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.885 0.374 . . . . 0.0 110.309 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.57 -21.93 35.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.938 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.479 ' HG3' ' HA ' ' A' ' 21' ' ' LEU . 0.4 OUTLIER -108.91 21.53 17.11 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.753 -179.432 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.664 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.1 OUTLIER -71.07 33.24 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -179.296 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.664 ' O ' ' O ' ' A' ' 25' ' ' GLN . 21.9 t 24.86 120.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 179.045 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 . . . . . 0 C--N 1.329 -0.301 0 CA-C-O 121.023 0.439 . . . . 0.0 110.573 178.678 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' A' ' 31' ' ' LEU . 4.2 mt . . . . . 0 N--CA 1.456 -0.145 0 CA-C-O 121.021 0.439 . . . . 0.0 111.317 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.583 HG22 ' HB3' ' A' ' 36' ' ' ASP . 15.0 p -79.94 150.25 5.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.386 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.3 m -79.65 172.92 13.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.153 0.501 . . . . 0.0 111.632 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.959 ' O ' HG23 ' A' ' 38' ' ' VAL . 1.2 tm-20 -67.52 -42.62 82.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.904 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -67.92 -37.79 82.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.19 0.519 . . . . 0.0 110.599 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.829 ' O ' HG23 ' A' ' 40' ' ' VAL . 9.0 t0 -67.96 -37.76 81.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.353 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.547 ' O ' HG23 ' A' ' 41' ' ' VAL . 6.4 tpt -68.43 -39.9 81.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.733 178.614 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.959 HG23 ' O ' ' A' ' 34' ' ' GLU . 92.6 t -56.77 -45.71 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.682 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -46.21 91.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.937 178.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.829 HG23 ' O ' ' A' ' 36' ' ' ASP . 37.0 t -55.46 -48.34 77.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.791 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 37' ' ' MET . 22.7 t -67.87 -41.35 84.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.925 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -43.68 79.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.105 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.584 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 2.8 p30 -71.54 -38.62 71.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.246 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.928 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 6.6 m0 -60.98 -41.34 96.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.019 0.438 . . . . 0.0 110.474 178.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.758 ' HG2' HD22 ' A' ' 74' ' ' LEU . 47.8 mtm -71.01 -40.81 71.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.783 -179.229 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -73.39 -35.21 65.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.028 0.442 . . . . 0.0 110.138 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.584 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -65.44 -42.0 92.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.207 179.603 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.442 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 4.5 m-85 -69.2 -44.39 72.24 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.738 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.577 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -54.39 -54.33 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.321 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.556 ' HA ' ' HG3' ' A' ' 53' ' ' ARG . 20.6 t30 -61.64 -36.75 81.7 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 121.367 0.603 . . . . 0.0 109.886 178.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.451 ' HB2' ' O ' ' A' ' 47' ' ' PHE . 1.1 t80 -59.04 -43.98 91.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.91 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.687 ' OH ' ' HA3' ' A' ' 14' ' ' GLY . 30.2 m-85 -75.36 -30.67 60.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.641 ' HA ' HD11 ' A' ' 67' ' ' LEU . 15.5 mtp85 -60.85 -31.26 70.71 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.63 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -93.36 -13.08 28.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.396 -178.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.486 ' O ' HD22 ' A' ' 10' ' ' LEU . 4.6 mm-40 -107.15 39.99 1.76 Allowed 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.48 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.767 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -118.06 153.69 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.298 178.555 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.44 171.54 9.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.365 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.97 -152.93 25.13 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.954 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.401 ' O ' ' HG3' ' A' ' 63' ' ' ARG . 7.7 mt-10 -73.66 161.34 79.24 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-O 120.727 0.299 . . . . 0.0 110.991 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.426 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 42.7 Cg_endo -67.76 -25.1 40.04 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.53 2.153 . . . . 0.0 112.671 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -43.87 81.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.858 0.361 . . . . 0.0 111.138 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -66.65 -44.38 82.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.408 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.767 ' HA ' HG11 ' A' ' 56' ' ' VAL . 11.4 mtt85 -53.65 -51.45 63.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.14 -41.73 84.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.969 -179.117 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.471 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 8.5 tttp -64.22 -31.12 72.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.946 0.403 . . . . 0.0 110.86 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.756 ' O ' HD23 ' A' ' 70' ' ' LEU . . . -73.85 -34.76 64.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.984 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.641 HD11 ' HA ' ' A' ' 53' ' ' ARG . 3.6 mp -71.71 -36.56 70.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.361 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 20.3 pt20 -71.81 -46.49 58.01 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.417 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.0 OUTLIER -62.78 -33.82 75.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.931 178.936 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.756 HD23 ' O ' ' A' ' 66' ' ' ALA . 1.5 mm? -64.3 -49.33 72.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.774 179.16 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.9 tpp85 -55.34 -47.43 75.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.653 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.15 -36.28 79.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.324 0.583 . . . . 0.0 109.658 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -60.96 -42.54 98.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.723 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.758 HD22 ' HG2' ' A' ' 45' ' ' MET . 6.3 mt -67.74 -45.1 75.96 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.215 0.531 . . . . 0.0 109.954 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -52.53 -38.92 60.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.944 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.407 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 3.0 m -80.78 -50.61 9.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.79 -37.76 66.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.057 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.36 -27.84 59.31 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.561 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.7 t-20 -51.62 -50.02 79.55 Favored Pre-proline 0 CA--C 1.533 0.289 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.764 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.561 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.6 Cg_endo -69.09 -32.61 20.98 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.304 2.002 . . . . 0.0 113.082 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.738 ' CG ' HD22 ' A' ' 22' ' ' LEU . 10.6 t80 -64.66 -53.72 42.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.913 0.387 . . . . 0.0 110.905 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.3 mt -54.89 -37.82 66.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.185 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.36 -45.65 83.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.803 0.335 . . . . 0.0 110.591 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -58.17 -40.74 82.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.775 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.492 ' HE2' HG13 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -73.82 -33.62 64.23 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.752 179.849 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -43.45 98.81 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -72.68 -31.42 65.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.055 178.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -72.46 -29.08 63.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.905 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 85' ' ' TYR . 3.0 mm? . . . . . 0 C--N 1.33 -0.28 0 CA-C-O 121.257 0.551 . . . . 0.0 110.067 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.6 mmtp . . . . . 0 N--CA 1.456 -0.136 0 CA-C-O 120.769 0.318 . . . . 0.0 110.636 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.69 -45.12 68.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.499 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.467 HD12 ' CD1' ' A' ' 52' ' ' TYR . 0.0 OUTLIER -61.2 -43.65 98.54 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.149 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.779 HD11 ' HB1' ' A' ' 66' ' ' ALA . 41.8 mm -64.0 -54.6 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.917 179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.449 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 35.9 m -57.91 -33.24 68.55 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.745 0.307 . . . . 0.0 110.947 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.45 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -66.12 -42.92 88.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.674 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.488 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -71.14 -38.42 63.44 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 177.28 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.6 mm? -54.68 -59.96 4.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.018 -1.091 . . . . 0.0 109.447 178.582 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.607 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.1 OUTLIER -59.43 -33.55 71.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.027 0.441 . . . . 0.0 110.041 179.41 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.0 tp10 -61.27 -49.16 78.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.637 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.599 ' CE2' HD23 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -72.32 -49.09 37.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.845 -179.723 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 87.9 p -55.31 -43.57 75.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.939 0.4 . . . . 0.0 110.381 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 16' ' ' LYS . 87.6 t -74.36 -27.36 21.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.436 179.351 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.908 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 21.6 tp -68.9 -46.17 69.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.892 0.377 . . . . 0.0 110.305 179.572 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.977 HD22 ' CD2' ' A' ' 81' ' ' PHE . 9.3 mt -71.94 -35.14 69.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.433 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -82.71 -23.69 33.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.565 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.451 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -109.8 10.62 24.58 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.415 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.4 162.41 0.15 Allowed 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.2 t -110.3 134.98 50.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 119.645 1.111 . . . . 0.0 110.671 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 5.9 m-85 . . . . . 0 C--N 1.325 -0.492 0 CA-C-O 121.784 0.802 . . . . 0.0 110.937 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.524 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.2 mp . . . . . 0 C--O 1.23 0.063 0 CA-C-O 121.153 0.501 . . . . 0.0 112.127 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.464 HG22 ' HB2' ' A' ' 36' ' ' ASP . 13.7 p -77.14 153.63 5.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.816 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.85 173.06 12.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.113 0.482 . . . . 0.0 111.636 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.904 ' O ' HG23 ' A' ' 38' ' ' VAL . 2.6 mt-10 -67.75 -39.16 84.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.165 -178.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -68.09 -37.36 81.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.136 0.493 . . . . 0.0 110.701 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.861 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.1 m-20 -70.5 -37.61 74.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.753 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.691 ' O ' HG23 ' A' ' 41' ' ' VAL . 16.2 tpp -66.99 -42.4 85.12 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.561 178.595 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 34' ' ' GLU . 99.1 t -56.85 -47.94 82.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.197 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -47.52 83.62 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.176 179.162 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.861 HG23 ' O ' ' A' ' 36' ' ' ASP . 39.1 t -55.7 -43.6 74.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.752 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.691 HG23 ' O ' ' A' ' 37' ' ' MET . 45.6 t -64.96 -45.47 94.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.712 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.46 -49.07 77.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.479 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -58.1 -43.26 87.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.882 179.306 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.908 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 5.3 m0 -60.64 -41.37 94.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.076 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.718 ' HG3' HD13 ' A' ' 74' ' ' LEU . 22.9 ttm -62.48 -50.57 70.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.053 -179.016 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -69.21 -35.47 76.25 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.472 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.37 -39.37 83.09 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.627 179.158 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.449 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 10.7 m-85 -72.24 -45.74 58.93 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.311 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 10.2 mm -54.07 -55.18 15.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.374 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -70.06 -35.99 74.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.906 0.384 . . . . 0.0 111.169 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.442 ' CE1' ' HG3' ' A' ' 55' ' ' GLN . 2.2 t80 -63.07 -45.8 90.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.502 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.491 ' O ' ' CG2' ' A' ' 56' ' ' VAL . 36.0 m-85 -75.5 -33.1 60.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.857 ' HB2' HD21 ' A' ' 67' ' ' LEU . 12.3 ttp85 -58.56 -30.98 67.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.818 0.342 . . . . 0.0 110.578 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -95.35 -11.07 28.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.889 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.442 ' HG3' ' CE1' ' A' ' 51' ' ' TYR . 1.8 mt-30 -99.86 -5.67 28.07 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -178.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.874 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.8 OUTLIER -73.15 154.01 7.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.711 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 18.7 p -120.87 171.16 8.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.476 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.56 -147.64 23.25 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.69 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.21 164.83 54.42 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.341 . . . . 0.0 110.862 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.405 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 42.6 Cg_endo -67.62 -22.53 44.01 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.616 2.211 . . . . 0.0 112.76 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.407 ' HA ' ' OD2' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -67.29 -44.02 80.31 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.149 0.5 . . . . 0.0 110.778 -179.934 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.6 -41.53 99.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.008 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.874 ' HA ' HG11 ' A' ' 56' ' ' VAL . 12.0 mtt180 -56.9 -51.17 70.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.009 179.333 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.407 ' OD2' ' HA ' ' A' ' 61' ' ' GLN . 0.3 OUTLIER -57.05 -41.71 79.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.433 -179.118 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.48 -49.73 76.37 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.461 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.779 ' HB1' HD11 ' A' ' 11' ' ' ILE . . . -56.9 -33.37 66.85 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.055 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.857 HD21 ' HB2' ' A' ' 53' ' ' ARG . 5.4 mp -71.18 -33.27 69.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.607 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -72.17 -49.04 38.82 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -62.24 -30.72 71.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.195 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.465 HD11 ' CE2' ' A' ' 52' ' ' TYR . 0.4 OUTLIER -67.39 -49.14 65.13 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.068 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.37 -48.32 74.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.783 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -72.11 -31.73 66.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.99 0.424 . . . . 0.0 110.071 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.429 ' OE2' HD11 ' A' ' 15' ' ' LEU . 3.5 mm-40 -61.64 -48.3 81.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.865 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.718 HD13 ' HG3' ' A' ' 45' ' ' MET . 9.2 mt -67.7 -44.68 77.15 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.048 0.451 . . . . 0.0 110.617 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.3 m-20 -52.8 -42.06 64.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.462 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.4 t -80.65 -34.19 35.09 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.436 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.479 HD13 ' HD2' ' A' ' 18' ' ' PHE . 2.8 mt -73.5 -30.22 62.99 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.106 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.11 -29.89 60.7 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -179.117 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.562 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 11.7 m-20 -57.33 -50.2 89.53 Favored Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 111.558 0.207 . . . . 0.0 111.558 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.562 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 44.9 Cg_endo -69.8 -37.59 8.86 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.36 2.04 . . . . 0.0 112.649 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.977 ' CD2' HD22 ' A' ' 22' ' ' LEU . 1.5 t80 -64.76 -52.57 56.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.055 0.455 . . . . 0.0 110.678 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.415 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 28.5 mt -57.1 -30.02 64.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.576 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.81 -48.04 64.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.558 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.83 -41.78 78.45 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.949 0.404 . . . . 0.0 110.266 179.347 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.653 ' CD2' ' HE2' ' A' ' 37' ' ' MET . 0.2 OUTLIER -74.65 -33.2 62.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.294 179.391 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.415 ' HB3' ' O ' ' A' ' 82' ' ' LEU . 0.0 OUTLIER -63.37 -42.45 98.87 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.935 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.64 -32.88 66.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.946 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.524 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 9.3 t80 -72.59 -28.78 63.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.049 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.518 HD23 ' O ' ' A' ' 85' ' ' TYR . 2.2 mm? . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.018 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.638 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.455 -0.192 0 CA-C-O 120.768 0.318 . . . . 0.0 110.603 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -67.26 -45.35 76.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.437 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.833 HD21 ' HG3' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -62.72 -42.19 99.53 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.506 -0.554 . . . . 0.0 109.506 178.73 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.638 HD12 ' HA ' ' A' ' 8' ' ' LYS . 25.4 mt -62.35 -54.06 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.037 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.2 t -57.47 -33.24 67.76 Favored 'General case' 0 C--N 1.333 -0.144 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 -179.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.12 -42.63 75.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.782 0.325 . . . . 0.0 110.861 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.61 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.91 -40.06 74.58 Favored Glycine 0 C--O 1.225 -0.459 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 177.16 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.902 HD21 ' HG2' ' A' ' 73' ' ' GLU . 1.7 mm? -54.81 -59.17 5.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.592 -1.304 . . . . 0.0 109.448 178.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.413 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -60.23 -30.93 69.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.543 179.685 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 0.6 OUTLIER -67.69 -46.36 72.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.241 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.599 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -69.74 -49.36 53.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.718 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 74.6 p -55.4 -50.44 69.75 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.133 0.492 . . . . 0.0 110.151 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.452 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 47.2 t -62.56 -34.55 65.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.271 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.966 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 12.2 tp -62.56 -46.22 89.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.469 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.997 HD13 ' HB2' ' A' ' 81' ' ' PHE . 6.0 mt -63.91 -37.24 86.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.095 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.69 -17.44 44.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.824 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 13.6 mt-30 -106.99 -3.4 20.14 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.103 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -46.9 160.09 0.09 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 19.7 t -104.69 128.41 58.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 118.81 0.732 . . . . 0.0 111.73 -179.114 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.838 179.258 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.513 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 0.7 OUTLIER . . . . . 0 N--CA 1.461 0.098 0 CA-C-O 121.364 0.602 . . . . 0.0 111.94 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.447 HG21 ' HB3' ' A' ' 36' ' ' ASP . 11.4 p -77.1 157.54 5.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.04 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.445 ' N ' HG22 ' A' ' 32' ' ' VAL . 3.0 p -79.51 171.01 15.74 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.263 0.554 . . . . 0.0 111.909 -178.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.893 ' O ' HG23 ' A' ' 38' ' ' VAL . 1.5 mt-10 -68.76 -34.45 75.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.112 -178.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -34.73 78.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.9 0.381 . . . . 0.0 110.716 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.886 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.3 OUTLIER -71.8 -42.15 67.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.115 179.454 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.671 ' O ' HG23 ' A' ' 41' ' ' VAL . 12.5 tpp -65.15 -43.43 91.83 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 34' ' ' GLU . 93.9 t -55.89 -48.0 79.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.305 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -46.62 88.23 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.864 0.364 . . . . 0.0 110.364 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.886 HG23 ' O ' ' A' ' 36' ' ' ASP . 23.7 t -56.75 -45.47 82.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.835 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.671 HG23 ' O ' ' A' ' 37' ' ' MET . 39.5 t -66.73 -44.98 89.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.789 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -51.16 71.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.415 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.2 OUTLIER -60.05 -43.48 95.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.156 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.966 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 7.9 m0 -60.78 -41.06 94.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.337 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.9 ttp -68.0 -43.98 77.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.327 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -70.87 -39.81 72.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.941 0.401 . . . . 0.0 110.014 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.445 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -59.38 -41.5 89.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.574 179.091 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.453 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 3.9 m-85 -65.01 -48.09 75.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.775 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.858 HD11 ' HB2' ' A' ' 71' ' ' ARG . 0.7 OUTLIER -54.2 -55.0 16.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.082 -179.395 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.457 ' N ' HG22 ' A' ' 49' ' ' ILE . 70.9 m-80 -68.97 -36.74 78.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.806 0.336 . . . . 0.0 111.085 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.445 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 7.0 t80 -63.07 -42.04 99.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.126 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.645 ' O ' HG22 ' A' ' 56' ' ' VAL . 27.8 m-85 -75.47 -33.68 60.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.54 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.674 ' HA ' HD11 ' A' ' 67' ' ' LEU . 2.8 ttm-85 -58.37 -31.59 67.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.12 0.486 . . . . 0.0 110.581 179.56 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -101.03 -9.81 21.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.196 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.833 ' HG3' HD21 ' A' ' 10' ' ' LEU . 12.4 tp-100 -97.54 -3.29 40.04 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.662 ' HB ' ' CG ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -78.81 173.58 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.469 179.564 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.457 HG22 ' H ' ' A' ' 58' ' ' GLY . 5.0 m -139.79 171.09 14.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.034 179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.457 ' H ' HG22 ' A' ' 57' ' ' THR . . . 88.15 -150.4 22.07 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.171 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.411 ' O ' ' HD2' ' A' ' 63' ' ' ARG . 0.4 OUTLIER -77.9 162.95 65.67 Favored Pre-proline 0 C--N 1.334 -0.103 0 CA-C-O 120.829 0.347 . . . . 0.0 111.286 -179.693 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.431 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 40.2 Cg_endo -67.26 -26.62 41.71 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.914 2.409 . . . . 0.0 113.319 -179.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -70.82 -44.18 67.05 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.067 0.461 . . . . 0.0 110.891 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -67.38 -38.25 84.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.959 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.662 ' CG ' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -57.64 -51.3 70.07 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.39 0.614 . . . . 0.0 109.427 178.896 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -58.06 -41.64 83.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.649 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 9.5 tttt -61.59 -49.69 75.62 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.474 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.1 -33.66 67.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.22 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.674 HD11 ' HA ' ' A' ' 53' ' ' ARG . 5.5 mp -69.99 -36.55 75.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.32 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 1.9 pp0? -72.89 -44.74 60.92 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.218 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -63.03 -38.59 91.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.351 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.447 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -63.39 -49.11 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.792 179.521 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.858 ' HB2' HD11 ' A' ' 49' ' ' ILE . 2.7 tpt180 -55.19 -44.85 75.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.523 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.26 -34.52 76.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.24 0.543 . . . . 0.0 109.846 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.902 ' HG2' HD21 ' A' ' 15' ' ' LEU . 1.2 tp10 -60.88 -45.3 95.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.068 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.9 mt -67.61 -45.08 76.46 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.972 0.415 . . . . 0.0 110.366 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -39.8 63.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.011 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.464 HG22 ' O ' ' A' ' 73' ' ' GLU . 10.3 t -80.55 -36.15 33.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.041 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.448 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 2.4 mt -71.24 -29.88 65.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.898 -179.436 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.84 -30.08 63.73 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.566 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.5 t30 -57.73 -50.09 90.06 Favored Pre-proline 0 CA--C 1.532 0.28 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.566 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 40.5 Cg_endo -67.69 -42.01 7.44 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.278 1.985 . . . . 0.0 112.828 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.997 ' HB2' HD13 ' A' ' 22' ' ' LEU . 1.8 t80 -63.76 -52.59 59.72 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.155 0.502 . . . . 0.0 110.036 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.403 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 24.1 mt -56.59 -29.28 61.9 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.429 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.445 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.03 -48.33 63.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.847 0.356 . . . . 0.0 110.519 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.2 mmtm -57.17 -40.78 77.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.551 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.46 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -77.61 -33.15 53.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.721 -179.544 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.445 ' HG2' ' HA ' ' A' ' 83' ' ' ALA . 1.0 OUTLIER -68.33 -40.52 81.57 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.016 179.409 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.59 -37.21 68.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.862 179.078 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.513 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 9.1 t80 -71.92 -29.22 64.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.14 178.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.746 HD23 ' HG2' ' A' ' 34' ' ' GLU . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.422 178.1 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 120.678 0.275 . . . . 0.0 110.852 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -62.32 -44.12 97.23 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.443 . . . . 0.0 109.831 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.44 ' HA ' HD22 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -60.63 -43.32 97.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.716 178.862 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.808 HD11 ' HB1' ' A' ' 66' ' ' ALA . 40.5 mm -62.04 -54.58 32.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.027 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.01 -32.91 22.77 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.668 0.271 . . . . 0.0 111.222 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.13 -42.06 69.7 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.596 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.554 ' N ' ' OH ' ' A' ' 52' ' ' TYR . . . -71.07 -28.42 70.39 Favored Glycine 0 C--O 1.231 -0.085 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 177.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.594 HD23 HG22 ' A' ' 11' ' ' ILE . 1.7 mm? -70.52 -61.17 1.87 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.511 -0.845 . . . . 0.0 109.092 178.364 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.619 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -57.21 -30.9 64.94 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.896 -179.954 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.419 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 1.5 mm-40 -68.24 -46.09 71.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.413 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.574 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -73.82 -47.38 39.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.351 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.52 -51.42 67.07 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.953 0.406 . . . . 0.0 110.484 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 16' ' ' LYS . 58.0 t -66.41 -36.77 78.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.642 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.992 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 0.8 OUTLIER -59.52 -46.18 89.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.76 0.314 . . . . 0.0 111.137 -179.818 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.918 HD13 ' HB2' ' A' ' 81' ' ' PHE . 15.0 mt -70.51 -34.92 72.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.987 0.422 . . . . 0.0 110.396 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -82.7 -18.43 40.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.154 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.489 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 10.2 mp0 -117.44 12.37 14.18 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -51.58 162.92 0.33 Allowed 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 177.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 24.2 t -112.57 136.41 48.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 119.854 1.206 . . . . 0.0 110.876 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.478 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.2 m-85 . . . . . 0 C--N 1.326 -0.442 0 CA-C-O 121.776 0.798 . . . . 0.0 110.545 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.461 HD22 ' CE2' ' A' ' 88' ' ' PHE . 7.6 mt . . . . . 0 N--CA 1.455 -0.18 0 CA-C-O 120.913 0.387 . . . . 0.0 111.058 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.545 HG22 ' HB3' ' A' ' 36' ' ' ASP . 14.9 p -74.83 143.91 12.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.829 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.7 p -79.97 172.79 13.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.957 0.408 . . . . 0.0 111.537 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.899 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -71.07 -29.66 65.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.423 -179.515 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.44 -38.27 81.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.223 0.535 . . . . 0.0 110.267 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.888 ' O ' HG23 ' A' ' 40' ' ' VAL . 4.9 t70 -71.83 -36.92 70.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.501 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.743 ' O ' HG23 ' A' ' 41' ' ' VAL . 1.8 tpt -67.05 -45.71 76.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.482 178.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.899 HG23 ' O ' ' A' ' 34' ' ' GLU . 89.7 t -55.78 -46.54 79.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.302 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -46.3 88.94 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.847 0.356 . . . . 0.0 110.16 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.888 HG23 ' O ' ' A' ' 36' ' ' ASP . 35.0 t -58.41 -44.05 87.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.696 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.743 HG23 ' O ' ' A' ' 37' ' ' MET . 24.9 t -65.48 -48.47 82.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.611 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.58 -46.52 77.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.464 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.632 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -64.53 -40.89 96.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.542 179.56 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.992 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 5.8 m0 -60.83 -43.99 97.53 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.948 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.7 mtm -66.96 -48.91 67.1 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.781 -178.208 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -71.13 -28.1 64.04 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.632 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.76 -48.13 82.07 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.125 179.262 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -71.69 -38.48 70.59 Favored 'General case' 0 C--O 1.227 -0.09 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.114 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.687 HD11 ' HB2' ' A' ' 71' ' ' ARG . 10.8 mm -57.41 -55.34 21.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.799 0.333 . . . . 0.0 111.274 -179.249 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -67.33 -39.71 85.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.186 0.517 . . . . 0.0 110.386 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.499 ' HB3' ' O ' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -61.07 -38.2 85.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.485 179.599 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.554 ' OH ' ' N ' ' A' ' 14' ' ' GLY . 3.2 m-85 -76.1 -36.74 58.79 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -178.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.832 ' HA ' HD11 ' A' ' 67' ' ' LEU . 6.6 ttm180 -59.96 -26.53 66.07 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.419 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 54' ' ' GLN . 6.9 tt0 -93.79 -13.51 27.26 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.492 ' HG3' ' CE1' ' A' ' 51' ' ' TYR . 18.7 mm-40 -103.09 1.94 34.03 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -178.326 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.538 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -85.85 168.96 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.288 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.1 p -142.58 171.34 14.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.837 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 87.39 -153.54 25.31 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.373 -0.918 . . . . 0.0 112.774 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.5 144.34 86.31 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-O 120.683 0.277 . . . . 0.0 110.891 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.472 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 19.1 Cg_endo -59.12 -24.6 74.47 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.79 2.327 . . . . 0.0 112.725 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.07 -38.32 75.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.938 0.399 . . . . 0.0 110.673 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -68.65 -47.0 67.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.284 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.538 ' HA ' HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -63.51 -50.7 68.58 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.114 0.483 . . . . 0.0 110.066 179.743 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.39 -37.36 67.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.085 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.69 -50.14 59.19 Favored 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.467 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.808 ' HB1' HD11 ' A' ' 11' ' ' ILE . . . -59.57 -35.0 73.43 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.22 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.832 HD11 ' HA ' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -69.44 -40.49 77.17 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.116 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -72.08 -41.62 67.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.079 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.504 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 7.9 mt-10 -66.78 -37.67 85.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.721 HD23 ' HA ' ' A' ' 67' ' ' LEU . 0.4 OUTLIER -67.04 -44.48 80.11 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.282 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.687 ' HB2' HD11 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -55.21 -49.01 73.05 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.828 179.509 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.504 ' HG2' ' HA ' ' A' ' 69' ' ' GLU . 8.4 pt20 -63.31 -31.83 73.09 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.586 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.53 ' O ' HG22 ' A' ' 76' ' ' THR . 5.8 tp10 -63.83 -42.45 97.63 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.719 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.494 HD22 ' CD2' ' A' ' 18' ' ' PHE . 5.2 mt -68.02 -45.38 74.18 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 121.134 0.492 . . . . 0.0 110.062 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.76 -37.14 65.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.004 -179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 73' ' ' GLU . 11.0 t -80.86 -32.8 34.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.704 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.419 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 1.5 mt -75.07 -29.64 60.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.895 -179.694 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.17 -32.1 61.18 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.552 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 3.1 m120 -52.12 -50.2 80.22 Favored Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 49.0 Cg_endo -69.92 -34.98 13.0 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.353 2.036 . . . . 0.0 112.76 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.918 ' HB2' HD13 ' A' ' 22' ' ' LEU . 1.8 t80 -65.31 -53.67 40.49 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.1 mt -58.81 -28.08 65.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.449 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.483 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.71 -41.3 75.55 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.105 0.479 . . . . 0.0 110.376 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -42.52 92.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.587 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.545 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.4 OUTLIER -74.62 -37.92 62.7 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.927 -179.38 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.483 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 12.1 ptm180 -65.32 -37.31 86.73 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.5 -34.91 67.99 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.25 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.461 ' CE2' HD22 ' A' ' 31' ' ' LEU . 45.6 t80 -72.05 -28.29 63.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.765 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mm? . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.408 179.142 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.637 ' HA ' HD12 ' A' ' 11' ' ' ILE . 1.6 tttm . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 120.68 0.276 . . . . 0.0 110.988 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -67.78 -40.38 83.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.842 0.353 . . . . 0.0 110.347 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.637 HD11 ' NE2' ' A' ' 55' ' ' GLN . 3.5 tp -65.22 -44.28 88.82 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.637 HD12 ' HA ' ' A' ' 8' ' ' LYS . 16.8 mt -61.95 -54.5 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.523 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 23.1 t -55.61 -39.74 71.16 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.21 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.11 -40.11 80.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.23 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.506 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -70.66 -30.86 68.13 Favored Glycine 0 N--CA 1.451 -0.308 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.523 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.7 mm? -64.9 -61.33 2.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.102 -1.049 . . . . 0.0 110.608 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.623 ' O ' HG23 ' A' ' 20' ' ' VAL . 6.3 mttm -62.17 -36.59 82.33 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -59.72 -50.67 72.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.97 178.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.626 ' CE2' HD13 ' A' ' 74' ' ' LEU . 1.0 OUTLIER -67.26 -50.54 60.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.101 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 t -57.81 -51.63 68.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.874 0.369 . . . . 0.0 111.089 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 16' ' ' LYS . 58.9 t -64.75 -32.57 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.769 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.928 HD11 ' CH2' ' A' ' 44' ' ' TRP . 0.2 OUTLIER -70.36 -46.26 64.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.103 179.73 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.952 HD22 ' CD2' ' A' ' 81' ' ' PHE . 13.8 mt -62.1 -37.58 85.62 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.441 -179.359 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.63 -38.79 23.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.727 0.298 . . . . 0.0 111.603 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.732 ' O ' ' N ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -106.46 21.31 17.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.776 -179.208 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.488 ' N ' ' O ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -46.27 60.96 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.416 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.732 ' N ' ' O ' ' A' ' 24' ' ' GLN . 11.6 p 27.96 102.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 123.42 0.688 . . . . 0.0 112.517 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.52 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 14.2 m-30 . . . . . 0 C--N 1.329 -0.288 0 CA-C-O 121.515 0.674 . . . . 0.0 111.185 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.489 HD11 ' CE2' ' A' ' 88' ' ' PHE . 7.1 mt . . . . . 0 N--CA 1.455 -0.206 0 CA-C-O 121.013 0.435 . . . . 0.0 111.363 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.505 HG12 ' OH ' ' A' ' 85' ' ' TYR . 7.2 p -76.7 148.59 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.312 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.9 m -79.22 169.69 17.75 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.164 0.506 . . . . 0.0 111.535 -177.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.88 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.4 OUTLIER -67.53 -36.61 81.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.03 -179.142 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -36.53 84.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.152 0.501 . . . . 0.0 110.353 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.922 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.6 OUTLIER -74.2 -37.62 63.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.337 178.505 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.873 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.2 OUTLIER -64.35 -47.23 80.14 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.716 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 34' ' ' GLU . 60.2 t -57.61 -45.48 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.803 178.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.0 m -57.96 -47.9 81.55 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.822 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.922 HG23 ' O ' ' A' ' 36' ' ' ASP . 40.8 t -57.65 -40.24 74.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.808 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.873 HG23 ' O ' ' A' ' 37' ' ' MET . 5.1 t -63.02 -48.05 89.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.528 179.521 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.495 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 0.3 OUTLIER -54.77 -45.58 74.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.735 179.726 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.554 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -72.15 -36.38 69.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.746 179.648 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.928 ' CH2' HD11 ' A' ' 21' ' ' LEU . 1.9 m0 -64.46 -45.33 87.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.321 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.941 ' CB ' HD12 ' A' ' 74' ' ' LEU . 1.9 ptm -71.5 -36.14 71.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.495 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -71.94 -40.81 68.47 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.554 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.5 -46.19 91.04 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.793 179.099 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.474 ' CD1' ' CZ ' ' A' ' 52' ' ' TYR . 3.4 m-85 -60.3 -47.67 85.04 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.644 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.4 mm -54.19 -55.34 14.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.357 -179.043 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.52 ' HA ' ' HG2' ' A' ' 53' ' ' ARG . 43.9 t30 -69.8 -33.39 72.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.029 0.442 . . . . 0.0 111.171 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.481 ' CZ ' ' NE2' ' A' ' 55' ' ' GLN . 17.0 t80 -68.19 -40.95 82.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.782 -179.226 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.506 ' OH ' ' HA3' ' A' ' 14' ' ' GLY . 21.9 m-85 -75.68 -36.56 60.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.348 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.756 ' HB3' HD21 ' A' ' 67' ' ' LEU . 7.1 ptp85 -59.88 -24.64 64.43 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.498 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -92.52 -23.64 19.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.519 -179.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.637 ' NE2' HD11 ' A' ' 10' ' ' LEU . 29.0 mt-30 -93.71 34.21 1.22 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.036 0.446 . . . . 0.0 111.666 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.542 HG11 ' HG3' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -112.97 164.76 8.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.093 -179.665 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.6 m -138.45 171.74 13.92 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 81.56 -163.4 44.35 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 119.869 -1.158 . . . . 0.0 112.866 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -64.55 160.55 51.29 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-O 120.872 0.368 . . . . 0.0 111.36 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.427 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 43.7 Cg_endo -67.62 -26.96 39.17 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.92 2.413 . . . . 0.0 112.984 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.415 ' HA ' ' OD2' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -55.62 -41.4 73.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.183 0.516 . . . . 0.0 111.287 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -63.37 -46.66 85.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.029 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.542 ' HG3' HG11 ' A' ' 56' ' ' VAL . 2.3 mpt_? -56.09 -51.63 67.19 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.166 0.508 . . . . 0.0 110.26 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.415 ' OD2' ' HA ' ' A' ' 61' ' ' GLN . 0.1 OUTLIER -55.58 -41.6 73.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.256 -178.901 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -49.72 76.45 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.98 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.2 -36.93 71.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.946 -179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.756 HD21 ' HB3' ' A' ' 53' ' ' ARG . 7.8 mp -70.47 -33.26 71.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.8 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.409 ' CG ' ' O ' ' A' ' 64' ' ' ASP . 1.2 mt-30 -73.55 -48.54 32.17 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.941 0.401 . . . . 0.0 110.192 179.221 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.27 -33.19 74.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.423 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.538 ' O ' HD23 ' A' ' 74' ' ' LEU . 0.8 OUTLIER -69.39 -48.27 61.64 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.749 -0.38 . . . . 0.0 109.978 179.195 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -55.23 -40.83 71.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.926 0.393 . . . . 0.0 110.392 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.0 -46.41 43.85 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.408 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 34.2 mm-40 -60.61 -34.1 73.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.033 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.941 HD12 ' CB ' ' A' ' 45' ' ' MET . 0.1 OUTLIER -68.86 -47.02 66.99 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.284 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -53.72 -37.23 63.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.877 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.543 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 1.0 OUTLIER -81.14 -50.74 9.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.048 179.546 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.572 HD22 HD12 ' A' ' 22' ' ' LEU . 3.9 mt -60.18 -39.54 86.85 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 -178.403 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.24 -46.95 81.55 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -177.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.507 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.5 OUTLIER -50.98 -50.48 74.6 Favored Pre-proline 0 CA--C 1.535 0.393 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.264 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.543 ' CD ' ' O ' ' A' ' 76' ' ' THR . 50.5 Cg_endo -69.86 -24.09 29.59 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 122.313 2.009 . . . . 0.0 112.946 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.952 ' CD2' HD22 ' A' ' 22' ' ' LEU . 1.3 t80 -67.84 -53.48 26.55 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.769 0.319 . . . . 0.0 110.89 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.12 -29.31 60.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.523 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.12 -47.51 57.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.39 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.2 mmmm -56.98 -38.99 73.8 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.496 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.505 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.6 OUTLIER -73.85 -33.89 64.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.54 179.779 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -42.47 99.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.133 0.492 . . . . 0.0 109.757 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.88 -32.4 65.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.181 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.52 ' CE2' ' CD2' ' A' ' 27' ' ' PHE . 22.0 t80 -73.55 -28.72 62.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.956 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 85' ' ' TYR . 4.8 mt . . . . . 0 C--N 1.329 -0.302 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.528 0.204 . . . . 0.0 111.048 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.411 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -70.26 -39.23 75.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.704 -0.226 . . . . 0.0 110.396 -179.946 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.506 HD22 ' O ' ' A' ' 55' ' ' GLN . 0.6 OUTLIER -65.67 -44.77 85.24 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 179.062 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.57 HD12 ' HB1' ' A' ' 66' ' ' ALA . 42.4 mm -62.06 -54.45 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.05 179.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.7 t -61.42 -34.29 75.13 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 120.815 0.34 . . . . 0.0 110.276 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.411 ' HB2' ' O ' ' A' ' 9' ' ' ASP . . . -59.11 -40.33 85.04 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.933 -179.352 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.481 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -68.96 -43.64 72.16 Favored Glycine 0 N--CA 1.454 -0.154 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 177.251 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.515 HD11 ' HG2' ' A' ' 73' ' ' GLU . 1.7 mm? -54.27 -58.62 6.69 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.081 -1.06 . . . . 0.0 109.613 178.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.554 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -60.84 -29.36 69.46 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.038 178.967 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.439 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 5.5 mt-10 -65.27 -48.9 71.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.977 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.506 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -65.49 -50.14 66.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.654 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -51.65 68.59 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.066 0.46 . . . . 0.0 110.787 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.554 HG23 ' O ' ' A' ' 16' ' ' LYS . 70.6 t -62.34 -28.26 44.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.477 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.98 HD11 ' CH2' ' A' ' 44' ' ' TRP . 1.5 tp -66.71 -46.45 75.51 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.818 HD13 ' HB2' ' A' ' 81' ' ' PHE . 2.1 mt -62.42 -38.1 88.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.776 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -24.88 34.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.31 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.454 ' C ' ' H ' ' A' ' 26' ' ' VAL . 3.1 tt0 -113.11 21.16 15.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.7 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.588 ' O ' ' O ' ' A' ' 26' ' ' VAL . 4.0 pp0? -70.25 34.59 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.295 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.588 ' O ' ' O ' ' A' ' 25' ' ' GLN . 16.5 t 31.93 115.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 178.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.578 ' CE2' ' NE2' ' A' ' 25' ' ' GLN . 2.7 m-85 . . . . . 0 CA--C 1.515 -0.369 0 CA-C-O 121.741 0.781 . . . . 0.0 110.682 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.452 ' HG ' ' N ' ' A' ' 32' ' ' VAL . 2.7 pt? . . . . . 0 CA--C 1.532 0.261 0 CA-C-O 120.618 0.246 . . . . 0.0 111.452 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.452 ' N ' ' HG ' ' A' ' 31' ' ' LEU . 13.7 p -74.49 138.92 20.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.411 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.8 p -80.31 175.37 10.71 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.016 0.436 . . . . 0.0 111.574 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.885 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -66.76 -38.89 87.51 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.117 -179.152 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.68 -36.07 82.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.287 0.565 . . . . 0.0 110.303 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.93 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -74.03 -34.81 64.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.427 178.77 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.791 ' O ' HG23 ' A' ' 41' ' ' VAL . 19.7 tpp -67.46 -47.31 70.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.629 178.649 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.885 HG23 ' O ' ' A' ' 34' ' ' GLU . 49.0 t -56.64 -47.66 81.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.423 179.369 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -58.07 -46.06 86.07 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.93 HG23 ' O ' ' A' ' 36' ' ' ASP . 48.2 t -59.13 -37.67 69.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.78 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 37' ' ' MET . 34.7 t -65.44 -49.13 80.17 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.781 0.324 . . . . 0.0 110.78 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.456 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 1.3 tt0 -55.37 -46.55 76.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.105 0.479 . . . . 0.0 110.777 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.625 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -71.74 -36.32 70.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.996 179.613 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.98 ' CH2' HD11 ' A' ' 21' ' ' LEU . 4.1 m0 -65.03 -45.82 83.87 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.523 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.828 ' CB ' HD12 ' A' ' 74' ' ' LEU . 1.6 ptm -71.41 -37.49 71.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.527 -179.399 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -71.34 -39.28 71.44 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.625 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.05 -45.88 92.97 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.058 179.194 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -61.64 -47.99 82.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.199 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.469 HG22 ' N ' ' A' ' 50' ' ' ASN . 0.6 OUTLIER -54.48 -55.28 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.217 -179.458 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.469 ' N ' HG22 ' A' ' 49' ' ' ILE . 30.0 t30 -69.46 -37.3 77.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.008 0.432 . . . . 0.0 111.09 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.461 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 21.2 t80 -61.26 -43.8 98.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.864 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.552 ' O ' HG22 ' A' ' 56' ' ' VAL . 23.5 m-85 -75.51 -29.29 59.46 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.244 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.795 ' CB ' HD21 ' A' ' 67' ' ' LEU . 10.4 ttm180 -57.55 -27.55 62.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.949 0.404 . . . . 0.0 110.172 178.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -101.81 -15.4 16.93 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.506 ' O ' HD22 ' A' ' 10' ' ' LEU . 26.5 mm-40 -97.53 46.21 1.03 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.821 0.343 . . . . 0.0 111.63 -179.247 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.833 HG21 ' HB3' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -125.3 164.62 24.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.299 -179.616 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 18.7 p -134.46 171.47 14.26 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 79.23 -149.95 33.03 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.016 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.98 156.12 92.46 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.822 0.344 . . . . 0.0 111.273 -179.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.517 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 42.8 Cg_endo -67.67 -25.94 39.79 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.73 2.287 . . . . 0.0 112.681 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.12 -41.68 93.16 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.894 0.378 . . . . 0.0 111.359 -179.546 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -61.1 -46.78 89.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.498 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.833 ' HB3' HG21 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.48 -50.81 68.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.207 0.527 . . . . 0.0 109.684 179.471 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -55.26 -41.4 72.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.693 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.462 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 14.5 ttmt -63.05 -49.91 72.7 Favored 'General case' 0 C--N 1.334 -0.104 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.656 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.57 ' HB1' HD12 ' A' ' 11' ' ' ILE . . . -57.23 -34.46 68.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.848 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.795 HD21 ' CB ' ' A' ' 53' ' ' ARG . 7.4 mp -71.81 -39.53 69.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.825 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 7.2 pt20 -73.2 -47.0 47.21 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.813 0.34 . . . . 0.0 110.403 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.49 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -62.32 -39.72 93.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.127 179.614 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.734 ' O ' HD23 ' A' ' 74' ' ' LEU . 7.0 mt -61.84 -48.89 78.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.197 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -55.45 -44.68 76.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.813 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.58 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -70.53 -38.26 74.21 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.142 0.496 . . . . 0.0 110.342 179.469 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.58 ' N ' ' HG3' ' A' ' 72' ' ' GLN . 1.7 tp10 -65.21 -32.78 74.62 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.24 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.828 HD12 ' CB ' ' A' ' 45' ' ' MET . 0.1 OUTLIER -68.44 -45.91 71.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.515 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -53.7 -39.71 65.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.988 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.481 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 7.3 t -80.74 -50.58 9.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.85 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.498 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.9 mt -58.07 -35.14 70.94 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -179.116 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.44 -38.37 71.33 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.114 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.534 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.9 m-80 -51.75 -50.28 78.51 Favored Pre-proline 0 C--N 1.328 -0.359 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.373 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 55.2 Cg_endo -70.08 -28.67 23.42 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.49 2.127 . . . . 0.0 113.18 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.818 ' HB2' HD13 ' A' ' 22' ' ' LEU . 2.3 t80 -65.51 -52.45 52.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.89 0.376 . . . . 0.0 111.4 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 55.0 mt -58.94 -28.64 66.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.841 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.25 -48.0 53.67 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.758 0.313 . . . . 0.0 110.434 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -56.93 -40.5 76.49 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.094 0.473 . . . . 0.0 110.115 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.5 ' CE2' ' HE2' ' A' ' 37' ' ' MET . 0.1 OUTLIER -70.95 -33.35 70.39 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.29 179.447 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 52.2 mmt-85 -61.52 -41.03 96.71 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.71 -31.11 64.76 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.352 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.498 ' CZ ' ' HB3' ' A' ' 27' ' ' PHE . 43.9 t80 -75.96 -28.75 58.03 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.213 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.455 HD13 ' HA ' ' A' ' 89' ' ' LEU . 2.1 mm? . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.564 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.688 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.152 0 CA-C-O 120.664 0.269 . . . . 0.0 111.038 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.4 -43.78 84.85 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.566 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.25 -46.36 90.07 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.801 179.046 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.688 HD12 ' HA ' ' A' ' 8' ' ' LYS . 12.8 mt -60.66 -54.36 36.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.481 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -53.92 -38.6 65.04 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 120.921 0.391 . . . . 0.0 110.435 179.57 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -58.49 -43.65 89.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.979 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.494 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -66.81 -28.05 73.6 Favored Glycine 0 N--CA 1.452 -0.239 0 N-CA-C 110.076 -1.21 . . . . 0.0 110.076 176.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.1 OUTLIER -68.58 -61.48 1.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.475 -0.862 . . . . 0.0 110.617 179.397 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.602 ' O ' HG23 ' A' ' 20' ' ' VAL . 2.6 mmtp -56.78 -35.38 68.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.143 0.497 . . . . 0.0 110.11 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.1 tt0 -59.87 -50.72 72.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.663 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE2' HD23 ' A' ' 74' ' ' LEU . 0.2 OUTLIER -73.59 -44.74 56.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.472 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.402 ' HA ' HD12 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -60.11 -51.67 68.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.89 0.376 . . . . 0.0 110.774 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 16' ' ' LYS . 47.6 t -66.91 -33.49 63.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.676 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 1.012 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 1.1 tp -68.44 -45.69 71.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.862 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.645 ' CD1' HD22 ' A' ' 77' ' ' LEU . 2.8 mt -63.15 -42.85 99.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.83 0.347 . . . . 0.0 110.814 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -82.8 -23.78 33.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.82 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.478 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -117.58 21.53 12.94 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -178.727 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.584 HE22 ' HE1' ' A' ' 27' ' ' PHE . 1.1 pp0? -67.05 42.23 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.321 0.105 . . . . 0.0 111.247 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.478 ' H ' ' C ' ' A' ' 24' ' ' GLN . 16.8 t -6.79 124.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.112 0.965 . . . . 0.0 113.558 -179.691 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.584 ' HE1' HE22 ' A' ' 25' ' ' GLN . 17.9 m-85 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.722 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.601 HD22 ' HE2' ' A' ' 88' ' ' PHE . 4.0 mt . . . . . 0 C--O 1.231 0.1 0 CA-C-O 121.091 0.472 . . . . 0.0 111.416 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.441 HG22 ' HB2' ' A' ' 36' ' ' ASP . 12.8 p -88.31 153.4 3.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.178 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.9 p -79.67 175.53 10.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.102 0.477 . . . . 0.0 111.806 -178.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.926 ' O ' HG23 ' A' ' 38' ' ' VAL . 14.5 pt-20 -70.3 -41.14 73.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.852 -178.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.34 -36.55 84.49 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.19 0.519 . . . . 0.0 110.496 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.847 ' O ' HG23 ' A' ' 40' ' ' VAL . 2.4 m-20 -73.49 -35.82 65.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.612 178.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.897 ' O ' HG23 ' A' ' 41' ' ' VAL . 2.7 tpt -66.87 -43.12 84.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.503 178.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.926 HG23 ' O ' ' A' ' 34' ' ' GLU . 50.5 t -59.48 -45.68 93.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.264 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -47.14 84.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.114 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.847 HG23 ' O ' ' A' ' 36' ' ' ASP . 22.9 t -58.6 -43.45 87.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.563 179.327 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 37' ' ' MET . 26.1 t -59.2 -48.83 85.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.589 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.55 -42.03 77.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.582 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -58.18 -46.44 85.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.149 179.368 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 1.012 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 28.8 m0 -60.69 -40.63 92.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.969 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.754 ' HG3' HD13 ' A' ' 74' ' ' LEU . 31.5 ttm -64.2 -50.89 66.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.769 -0.65 . . . . 0.0 112.379 -178.291 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -70.24 -29.31 66.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.002 0.43 . . . . 0.0 110.18 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.472 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.81 -42.33 97.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.122 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.428 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 27.0 m-85 -73.06 -41.74 63.83 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.527 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.9 mm -55.7 -55.4 17.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.499 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -69.48 -38.37 77.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.965 0.412 . . . . 0.0 110.968 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.413 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.7 t80 -59.89 -46.2 90.09 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.212 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.522 ' CE2' HD11 ' A' ' 70' ' ' LEU . 23.0 m-85 -75.84 -28.93 58.42 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.811 ' HB2' HD21 ' A' ' 67' ' ' LEU . 11.4 ttm180 -65.22 -28.66 69.52 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.746 -0.381 . . . . 0.0 110.757 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -91.49 -21.78 20.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.092 -178.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -94.17 46.1 1.15 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.657 HG11 ' HG3' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -132.19 -176.13 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.237 0.541 . . . . 0.0 112.0 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.985 ' O ' ' N ' ' A' ' 59' ' ' GLU . 1.5 p -128.49 163.67 24.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.399 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.403 ' O ' ' HD2' ' A' ' 60' ' ' PRO . . . -32.81 50.4 0.0 OUTLIER Glycine 0 N--CA 1.473 1.134 0 N-CA-C 115.003 0.761 . . . . 0.0 115.003 -178.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.985 ' N ' ' O ' ' A' ' 57' ' ' THR . 2.2 mm-40 -110.57 65.11 0.44 Allowed Pre-proline 0 N--CA 1.432 -1.346 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 176.09 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.403 ' HD2' ' O ' ' A' ' 58' ' ' GLY . 6.4 Cg_endo -51.42 -43.37 50.15 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 121.173 1.248 . . . . 0.0 111.015 -178.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -71.02 -36.3 72.36 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.621 178.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 59' ' ' GLU . 0.1 OUTLIER -79.63 -35.05 40.03 Favored 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 119.781 -0.768 . . . . 0.0 111.996 -179.68 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.657 ' HG3' HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -65.84 -52.5 49.92 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 179.758 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.29 -41.55 84.65 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.976 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.44 -45.79 71.58 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 119.946 -0.702 . . . . 0.0 110.077 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.95 -39.72 75.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.116 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.811 HD21 ' HB2' ' A' ' 53' ' ' ARG . 7.2 mp -69.82 -35.33 74.7 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.024 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.451 ' O ' ' HG2' ' A' ' 71' ' ' ARG . 3.9 mm-40 -70.42 -46.97 62.89 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.192 0.52 . . . . 0.0 109.728 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.1 -27.24 67.91 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.178 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.522 HD11 ' CE2' ' A' ' 52' ' ' TYR . 0.5 OUTLIER -73.36 -50.17 23.38 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.433 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 13.9 ptm180 -57.63 -41.56 81.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.304 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -31.36 61.09 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -61.59 -46.77 88.43 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.256 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.754 HD13 ' HG3' ' A' ' 45' ' ' MET . 1.2 mt -67.92 -42.83 80.47 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-O 121.051 0.453 . . . . 0.0 110.182 178.038 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -52.47 -42.08 63.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.177 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.1 t -81.13 -29.69 34.71 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.815 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.645 HD22 ' CD1' ' A' ' 22' ' ' LEU . 5.9 mt -79.37 -37.86 36.34 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.784 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.71 -29.89 59.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.626 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.567 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -51.07 -50.3 76.06 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.885 -178.975 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.567 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 45.7 Cg_endo -69.4 -31.02 22.98 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.061 1.841 . . . . 0.0 112.39 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.537 ' CD2' HD23 ' A' ' 22' ' ' LEU . 1.1 t80 -69.85 -54.59 12.84 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.602 HD21 HG21 ' A' ' 41' ' ' VAL . 73.7 mt -55.77 -34.45 65.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.146 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.643 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . . . -62.43 -48.28 80.37 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.299 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -44.7 88.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.966 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -71.32 -41.01 70.4 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.643 ' HG2' ' HA ' ' A' ' 83' ' ' ALA . 0.4 OUTLIER -62.75 -36.73 83.97 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.175 -179.71 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.441 ' N ' ' HG3' ' A' ' 86' ' ' ARG . 0.5 OUTLIER -72.82 -36.4 67.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.197 0.522 . . . . 0.0 109.93 178.645 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.601 ' HE2' HD22 ' A' ' 31' ' ' LEU . 18.5 t80 -70.5 -32.86 70.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.687 179.425 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.2 mm? . . . . . 0 C--N 1.331 -0.235 0 CA-C-O 121.42 0.629 . . . . 0.0 109.622 178.502 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.469 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 120.737 0.303 . . . . 0.0 110.894 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -71.17 -41.13 70.75 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.572 HD21 ' HG3' ' A' ' 55' ' ' GLN . 6.4 tp -62.13 -46.06 90.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.975 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.496 ' CG2' ' N ' ' A' ' 12' ' ' SER . 0.4 OUTLIER -62.99 -53.86 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 C-N-CA 120.506 -0.478 . . . . 0.0 109.743 179.174 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.496 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -55.83 -33.06 64.13 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 120.91 0.386 . . . . 0.0 110.433 179.503 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.01 -41.6 90.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.583 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.498 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.56 -42.44 72.53 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 177.147 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.477 HD21 ' OE1' ' A' ' 73' ' ' GLU . 3.9 mt -54.52 -59.52 4.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 113.844 -1.178 . . . . 0.0 109.32 178.761 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.542 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -59.59 -29.42 67.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.739 179.687 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.411 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 7.3 tt0 -68.47 -45.84 71.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.191 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.782 ' CD2' HD23 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -74.3 -48.45 28.31 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.065 -179.825 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 77.7 p -55.69 -49.75 72.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.031 0.444 . . . . 0.0 110.353 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 16' ' ' LYS . 91.3 t -68.24 -33.12 58.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.521 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.581 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 4.5 tp -63.77 -45.9 87.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.798 0.333 . . . . 0.0 110.725 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.664 ' CD1' HD22 ' A' ' 77' ' ' LEU . 4.8 mt -68.5 -36.63 79.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.952 0.406 . . . . 0.0 110.196 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -82.53 -17.54 44.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.505 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.446 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 31.1 mt-30 -111.11 14.25 21.86 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.401 ' HG3' ' CZ ' ' A' ' 81' ' ' PHE . 0.6 OUTLIER -49.47 162.73 0.14 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.734 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.52 131.73 58.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 119.491 1.041 . . . . 0.0 111.372 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 . . . . . 0 C--N 1.325 -0.474 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.939 179.433 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.403 HD23 ' N ' ' A' ' 31' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.522 -0.122 0 CA-C-O 121.07 0.462 . . . . 0.0 111.024 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.2 p -70.41 143.67 14.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.195 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.96 172.14 14.17 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.278 0.561 . . . . 0.0 112.121 -178.158 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.887 ' O ' HG23 ' A' ' 38' ' ' VAL . 29.3 mt-10 -62.34 -43.78 98.02 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.328 -178.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -34.83 78.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.127 0.489 . . . . 0.0 110.929 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.899 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.2 m-20 -73.99 -36.95 64.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.656 178.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.627 ' O ' HG23 ' A' ' 41' ' ' VAL . 3.5 tpt -66.81 -47.95 70.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.639 178.66 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 34' ' ' GLU . 44.3 t -55.73 -45.79 79.44 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.236 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -58.12 -46.03 86.27 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.899 HG23 ' O ' ' A' ' 36' ' ' ASP . 46.0 t -57.75 -41.53 79.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.996 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 37' ' ' MET . 21.6 t -70.43 -46.96 68.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.23 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.05 -47.5 80.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.031 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.606 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 3.3 p30 -68.96 -35.05 76.31 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.061 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.581 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 3.9 m0 -60.72 -43.63 97.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.85 178.723 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.8 mtm -68.5 -45.71 71.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.661 -178.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.46 ' ND2' ' HA ' ' A' ' 43' ' ' ASP . 0.4 OUTLIER -71.58 -32.0 67.57 Favored 'General case' 0 CA--C 1.521 -0.154 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.914 179.707 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.606 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.96 -47.01 86.75 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.697 179.072 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.492 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 12.3 m-85 -65.88 -42.68 90.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.934 0.397 . . . . 0.0 110.582 179.687 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.407 ' HA ' HD13 ' A' ' 49' ' ' ILE . 12.4 mm -55.63 -55.44 17.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.364 -179.585 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -72.33 -38.64 68.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.123 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.471 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 13.4 t80 -60.71 -46.38 90.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.998 -179.63 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.623 ' O ' HG22 ' A' ' 56' ' ' VAL . 30.2 m-85 -75.6 -29.75 59.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.938 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.551 ' CB ' HD21 ' A' ' 67' ' ' LEU . 33.2 ttm180 -61.85 -27.95 69.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.826 0.346 . . . . 0.0 110.575 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -97.08 -16.01 20.71 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -178.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.572 ' HG3' HD21 ' A' ' 10' ' ' LEU . 6.0 pt20 -107.01 43.21 1.19 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.202 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.735 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -117.15 156.94 18.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.631 0.253 . . . . 0.0 110.364 178.538 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.4 p -131.08 171.46 13.22 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 85.24 -156.78 31.16 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.776 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -68.6 159.96 79.08 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.742 0.306 . . . . 0.0 111.034 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.412 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 43.3 Cg_endo -67.4 -27.97 39.56 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.641 2.227 . . . . 0.0 112.333 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -42.25 99.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.848 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.45 -46.59 85.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.559 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.735 ' HA ' HG11 ' A' ' 56' ' ' VAL . 7.9 mtt180 -53.74 -51.84 62.06 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.8 -42.15 75.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.563 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.427 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 2.2 tttt -63.75 -31.94 73.28 Favored 'General case' 0 CA--C 1.522 -0.111 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.732 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.69 -40.74 65.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.551 HD21 ' CB ' ' A' ' 53' ' ' ARG . 6.8 mp -71.71 -33.46 68.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.597 -179.558 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 18.6 pt20 -74.05 -48.97 26.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.868 0.366 . . . . 0.0 110.155 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.411 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 13.6 tt0 -63.11 -33.19 74.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.476 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.7 mt -67.69 -49.33 63.29 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 67.9 ttp85 -55.41 -45.75 76.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.607 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -71.98 -32.78 67.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.202 0.525 . . . . 0.0 109.851 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.477 ' OE1' HD21 ' A' ' 15' ' ' LEU . 15.8 mm-40 -63.49 -46.92 83.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.068 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.782 HD23 ' CD2' ' A' ' 18' ' ' PHE . 0.9 OUTLIER -67.9 -45.25 74.96 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 121.085 0.469 . . . . 0.0 110.396 178.699 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.09 -39.39 63.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.915 -179.337 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.1 p -80.69 -33.74 35.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.982 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.664 HD22 ' CD1' ' A' ' 22' ' ' LEU . 4.9 mt -73.14 -31.21 64.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.968 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.34 -30.26 61.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -179.01 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.56 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.6 m-80 -56.4 -50.34 88.24 Favored Pre-proline 0 C--N 1.328 -0.327 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -179.464 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.56 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 54.1 Cg_endo -69.67 -38.96 7.26 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.415 2.077 . . . . 0.0 112.667 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.519 ' CB ' HD22 ' A' ' 22' ' ' LEU . 6.1 t80 -62.91 -53.47 53.55 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.011 0.434 . . . . 0.0 110.5 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.1 mt -56.02 -30.57 62.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.749 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.522 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.0 -43.24 75.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.957 0.408 . . . . 0.0 110.528 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.3 mtmt -62.2 -43.3 99.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.818 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.441 ' O ' HD23 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -77.28 -33.55 55.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.875 -179.388 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.522 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 8.4 ptm180 -67.1 -38.5 85.76 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.183 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.75 -36.26 67.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.657 178.596 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -71.55 -29.09 64.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.392 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.441 HD23 ' O ' ' A' ' 85' ' ' TYR . 0.7 OUTLIER . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.653 178.451 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.706 0.288 . . . . 0.0 110.512 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -65.89 -45.04 83.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.146 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.726 HD11 ' NE2' ' A' ' 55' ' ' GLN . 2.6 tp -59.9 -45.1 93.6 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 179.252 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.742 HG22 HD13 ' A' ' 15' ' ' LEU . 37.3 mm -60.05 -54.22 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.2 p -51.09 -32.98 24.13 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.817 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.03 -44.9 71.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.407 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.481 ' HA2' ' OE2' ' A' ' 17' ' ' GLU . . . -66.55 -28.14 73.57 Favored Glycine 0 N--CA 1.452 -0.296 0 N-CA-C 110.694 -0.962 . . . . 0.0 110.694 177.72 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.742 HD13 HG22 ' A' ' 11' ' ' ILE . 2.6 mp -75.45 -60.68 2.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.388 -0.906 . . . . 0.0 110.964 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.791 ' O ' HG23 ' A' ' 20' ' ' VAL . 12.7 ttpp -60.39 -36.81 78.95 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.712 0.291 . . . . 0.0 110.84 -179.467 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.481 ' OE2' ' HA2' ' A' ' 14' ' ' GLY . 8.1 pt-20 -67.37 -47.73 69.52 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.486 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.449 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 1.3 t80 -65.98 -44.39 85.01 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.205 179.114 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 71.2 m -56.84 -51.59 68.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.591 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 16' ' ' LYS . 58.7 t -63.42 -29.36 47.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.412 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.969 HD11 ' CH2' ' A' ' 44' ' ' TRP . 19.1 tp -70.26 -45.88 65.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.471 179.652 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.777 HD22 ' CD2' ' A' ' 81' ' ' PHE . 6.3 mt -65.95 -40.92 91.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.168 -179.634 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -82.52 -39.13 22.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.614 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.02 21.15 16.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.706 -179.379 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.659 ' O ' HG23 ' A' ' 26' ' ' VAL . 0.0 OUTLIER -36.06 -53.66 0.78 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.144 -179.855 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.659 HG23 ' O ' ' A' ' 25' ' ' GLN . 47.2 t 121.48 111.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.149 0.979 . . . . 0.0 110.405 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 8.2 m-30 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.54 179.086 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.458 -0.071 0 CA-C-O 121.46 0.648 . . . . 0.0 112.256 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.628 HG12 ' OH ' ' A' ' 85' ' ' TYR . 14.1 p -80.45 157.82 4.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.984 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.458 ' N ' HG22 ' A' ' 32' ' ' VAL . 5.9 m -79.18 171.36 15.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.243 0.544 . . . . 0.0 111.687 -178.441 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.873 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -69.28 -37.5 77.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.943 -178.685 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.65 -32.96 74.6 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.955 0.407 . . . . 0.0 111.031 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.895 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -74.33 -39.51 62.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.985 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.907 ' O ' HG23 ' A' ' 41' ' ' VAL . 4.4 tpp -67.53 -45.17 76.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.881 179.069 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.873 HG23 ' O ' ' A' ' 34' ' ' GLU . 56.3 t -59.23 -44.35 91.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.611 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -61.05 -46.68 89.72 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.378 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 36' ' ' ASP . 43.2 t -58.8 -43.77 88.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.874 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.907 HG23 ' O ' ' A' ' 37' ' ' MET . 13.8 t -65.29 -46.25 91.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.848 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.69 -45.22 85.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.565 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.445 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -66.46 -42.31 87.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.49 179.495 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.969 ' CH2' HD11 ' A' ' 21' ' ' LEU . 9.5 m0 -60.87 -38.97 87.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.895 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 42.5 mtm -71.06 -42.24 69.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.246 -178.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -72.01 -40.52 68.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.852 0.358 . . . . 0.0 110.302 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.452 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -63.65 -39.37 94.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.019 179.382 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.43 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 1.6 m-85 -66.47 -48.46 69.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.063 -179.614 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.496 HG22 ' N ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -57.42 -55.75 19.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.758 -179.532 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.496 ' N ' HG22 ' A' ' 49' ' ' ILE . 33.9 t30 -63.14 -38.68 92.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.932 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.452 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 4.3 t80 -62.85 -45.93 90.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.621 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.504 ' CE2' HD11 ' A' ' 70' ' ' LEU . 32.7 m-85 -70.51 -30.39 67.14 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -178.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.589 ' HA ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -61.23 -19.39 61.6 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.019 179.633 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -102.42 -16.69 16.11 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.142 0.794 . . . . 0.0 113.142 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.726 ' NE2' HD11 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -100.18 46.16 0.96 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 120.617 -0.433 . . . . 0.0 112.081 -179.307 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.968 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -120.08 159.72 21.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.961 0.41 . . . . 0.0 111.106 179.396 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.6 p -134.71 171.74 13.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 82.56 -161.71 40.88 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.273 -0.965 . . . . 0.0 112.95 179.44 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.77 162.72 26.32 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-O 120.816 0.341 . . . . 0.0 111.007 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.56 -32.02 32.16 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.567 2.178 . . . . 0.0 112.557 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.54 -42.53 96.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.008 0.432 . . . . 0.0 111.047 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -62.35 -46.76 87.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.528 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.968 ' HA ' HG11 ' A' ' 56' ' ' VAL . 5.5 mtt180 -53.56 -52.13 60.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.286 0.565 . . . . 0.0 109.492 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -55.42 -42.23 73.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.45 -178.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.442 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 1.0 OUTLIER -61.76 -34.65 76.23 Favored 'General case' 0 CA--C 1.521 -0.137 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.506 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.506 ' HB1' HD11 ' A' ' 11' ' ' ILE . . . -71.29 -43.59 66.83 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.086 179.112 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.589 HD11 ' HA ' ' A' ' 53' ' ' ARG . 1.1 mp -66.08 -38.69 88.9 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.709 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 0.6 OUTLIER -70.01 -44.66 68.85 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.231 179.843 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 0.5 OUTLIER -62.3 -34.28 76.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.405 179.467 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.504 HD11 ' CE2' ' A' ' 52' ' ' TYR . 0.5 OUTLIER -65.1 -49.65 69.16 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.14 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.407 ' HB2' HD11 ' A' ' 49' ' ' ILE . 4.3 ttm-85 -55.28 -48.7 73.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.861 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.434 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.1 OUTLIER -68.68 -31.21 70.16 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.187 0.518 . . . . 0.0 110.092 179.196 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 0.0 OUTLIER -62.17 -45.7 92.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.948 179.761 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.61 -44.39 78.18 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.147 0.499 . . . . 0.0 110.29 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -52.25 -43.43 64.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.142 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.47 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 66.6 m -79.95 -50.48 10.36 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.708 0.289 . . . . 0.0 111.246 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 4.4 mt -56.69 -37.94 71.57 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.43 -37.05 77.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -178.174 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.529 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.1 t30 -51.65 -50.54 76.66 Favored Pre-proline 0 CA--C 1.534 0.335 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.545 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 53.2 Cg_endo -69.94 -34.68 13.51 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.583 2.189 . . . . 0.0 113.338 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.777 ' CD2' HD22 ' A' ' 22' ' ' LEU . 1.4 t80 -64.41 -53.79 42.99 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.698 0.285 . . . . 0.0 110.76 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.1 mt -53.94 -29.93 44.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.65 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.09 -44.7 65.16 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.257 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.0 -43.05 81.35 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.586 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.628 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -73.44 -33.33 64.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.942 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -46.09 83.81 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.93 -32.23 70.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.932 178.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.511 ' CE2' ' CD2' ' A' ' 27' ' ' PHE . 5.6 t80 -72.1 -28.76 63.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.448 179.112 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.537 HD23 ' O ' ' A' ' 85' ' ' TYR . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.022 179.32 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.564 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.892 0.377 . . . . 0.0 110.954 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -72.76 -44.35 61.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.863 0.363 . . . . 0.0 110.213 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.782 HD11 ' HG3' ' A' ' 55' ' ' GLN . 5.1 tp -59.86 -49.29 78.29 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.361 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.794 HD11 ' HG3' ' A' ' 73' ' ' GLU . 0.1 OUTLIER -57.25 -49.73 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.042 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -55.24 -33.02 62.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.757 179.324 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.413 ' O ' ' HG2' ' A' ' 16' ' ' LYS . . . -67.92 -44.13 77.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.378 -179.527 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.485 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.59 -40.18 77.89 Favored Glycine 0 C--O 1.229 -0.175 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 177.19 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.654 HD23 HD11 ' A' ' 77' ' ' LEU . 3.3 mt -54.48 -59.21 4.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 113.761 -1.22 . . . . 0.0 109.557 178.671 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.811 ' O ' HG23 ' A' ' 20' ' ' VAL . 11.0 pttm -59.57 -31.02 69.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.418 179.444 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.2 -46.9 75.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.129 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.584 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -64.11 -49.17 73.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.095 -179.817 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 98.0 p -55.17 -51.41 66.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.875 0.369 . . . . 0.0 111.065 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 16' ' ' LYS . 38.1 t -61.42 -40.58 86.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.155 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.66 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 0.4 OUTLIER -64.47 -46.11 84.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.081 -179.589 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.974 HD22 ' CG ' ' A' ' 81' ' ' PHE . 33.0 mt -62.99 -36.54 83.86 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.301 -179.289 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -82.65 -22.42 34.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.602 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.467 ' C ' ' H ' ' A' ' 26' ' ' VAL . 1.7 mt-30 -117.4 21.86 12.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.668 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.522 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -66.01 37.08 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -179.162 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.522 ' O ' ' O ' ' A' ' 25' ' ' GLN . 18.4 t 31.6 112.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 178.68 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 88' ' ' PHE . 34.0 m-85 . . . . . 0 CA--C 1.519 -0.218 0 CA-C-O 121.357 0.599 . . . . 0.0 110.627 178.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.517 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.9 mp . . . . . 0 CA--C 1.521 -0.171 0 CA-C-O 121.131 0.491 . . . . 0.0 111.664 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.65 HG12 ' OH ' ' A' ' 85' ' ' TYR . 13.8 p -76.45 148.9 6.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.33 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.4 m -79.77 172.41 13.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.144 0.497 . . . . 0.0 111.503 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.937 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -67.56 -38.95 84.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.732 -179.131 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -66.74 -37.31 84.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.164 0.507 . . . . 0.0 110.344 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.791 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.1 m-20 -68.55 -39.32 81.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.612 178.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.544 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -66.2 -41.66 89.89 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.478 178.742 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.937 HG23 ' O ' ' A' ' 34' ' ' GLU . 96.7 t -55.85 -47.94 78.98 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.915 179.069 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -46.92 85.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.988 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 36' ' ' ASP . 39.1 t -55.63 -52.03 52.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.76 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 37' ' ' MET . 38.9 t -61.03 -42.91 94.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.446 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.41 -50.24 74.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.451 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.487 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -59.18 -46.3 88.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.439 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.66 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 16.0 m0 -60.7 -40.45 92.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.583 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.431 ' HG3' HD13 ' A' ' 74' ' ' LEU . 3.2 ttp -67.74 -42.9 81.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.8 -179.288 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -73.51 -34.75 65.41 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.487 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.89 -45.22 90.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.763 179.157 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -65.45 -46.5 79.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.273 -179.335 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.818 HD11 ' HB2' ' A' ' 71' ' ' ARG . 0.6 OUTLIER -58.53 -55.5 22.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.66 -179.772 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.489 ' N ' HG22 ' A' ' 49' ' ' ILE . 18.1 t30 -62.47 -42.21 99.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.781 179.448 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.505 ' CD1' ' OE1' ' A' ' 55' ' ' GLN . 13.8 t80 -60.13 -48.89 79.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.771 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.633 ' CE2' HD21 ' A' ' 70' ' ' LEU . 5.3 m-85 -64.5 -33.66 76.41 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -179.374 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.621 ' HA ' HD11 ' A' ' 67' ' ' LEU . 5.8 mtm105 -56.37 -26.35 52.62 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.375 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -99.26 -16.15 18.61 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.782 ' HG3' HD11 ' A' ' 10' ' ' LEU . 1.9 pt20 -103.4 38.9 1.68 Allowed 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.612 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.671 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -110.56 159.13 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 178.465 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.437 HG22 ' H ' ' A' ' 58' ' ' GLY . 2.0 m -129.58 171.5 12.53 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.437 ' H ' HG22 ' A' ' 57' ' ' THR . . . 87.36 -155.9 27.61 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.893 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.2 160.33 83.01 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.706 0.289 . . . . 0.0 110.829 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.577 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 27.2 Cg_endo -62.23 -32.64 82.41 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.68 2.253 . . . . 0.0 112.718 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -62.47 -43.11 99.61 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.213 0.53 . . . . 0.0 110.871 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -60.68 -40.9 93.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.016 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.895 ' O ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -58.08 -50.95 71.69 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.686 179.271 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.37 -41.67 72.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.391 -179.039 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 5.7 tttm -66.52 -49.86 65.12 Favored 'General case' 0 CA--C 1.522 -0.112 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.278 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.42 -37.29 72.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.69 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.895 HD13 ' O ' ' A' ' 63' ' ' ARG . 8.1 mp -66.67 -41.81 87.57 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.093 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.414 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 1.7 pp0? -67.82 -41.7 82.67 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.85 0.357 . . . . 0.0 110.318 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.401 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 0.5 OUTLIER -62.25 -38.61 89.92 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.248 179.691 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.633 HD21 ' CE2' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -61.4 -48.7 80.03 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.011 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.818 ' HB2' HD11 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -55.27 -48.97 73.25 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.088 -179.66 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.6 -32.67 72.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.075 0.464 . . . . 0.0 110.223 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.794 ' HG3' HD11 ' A' ' 11' ' ' ILE . 25.1 mm-40 -60.59 -45.59 93.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.953 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.431 HD13 ' HG3' ' A' ' 45' ' ' MET . 10.1 mt -67.76 -44.44 77.49 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.022 0.439 . . . . 0.0 110.521 178.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -52.64 -42.78 64.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.227 -179.091 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.1 m -78.29 -32.74 49.59 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.023 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.654 HD11 HD23 ' A' ' 15' ' ' LEU . 2.7 mt -72.72 -30.67 64.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.844 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.79 -28.87 60.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.571 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.7 t30 -58.49 -50.17 89.5 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.822 0.304 . . . . 0.0 111.822 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.571 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 46.7 Cg_endo -69.03 -41.01 5.65 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.462 2.108 . . . . 0.0 113.014 -179.605 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.974 ' CG ' HD22 ' A' ' 22' ' ' LEU . 5.1 t80 -58.21 -50.18 74.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.033 0.444 . . . . 0.0 110.869 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.1 mt -54.53 -37.24 65.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.327 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.24 -44.27 79.86 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.771 0.319 . . . . 0.0 110.615 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.83 -40.88 76.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.067 0.46 . . . . 0.0 110.34 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.65 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.4 OUTLIER -76.15 -33.36 59.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.632 179.499 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.43 ' HG2' ' N ' ' A' ' 87' ' ' ASP . 0.0 OUTLIER -61.12 -45.92 92.73 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.054 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.43 ' N ' ' HG2' ' A' ' 86' ' ' ARG . 0.4 OUTLIER -71.05 -33.57 70.4 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.071 178.939 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.517 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 16.8 t80 -69.59 -28.81 66.28 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.263 178.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.621 HD23 ' HG3' ' A' ' 34' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.208 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 178.23 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.459 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.148 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.404 ' N ' ' HG3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -74.79 -46.17 38.71 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.495 -179.79 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.793 HD11 ' HG3' ' A' ' 55' ' ' GLN . 0.5 OUTLIER -59.57 -49.06 79.22 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.787 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.487 ' CG2' ' N ' ' A' ' 12' ' ' SER . 1.2 tt -56.77 -51.64 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.22 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.487 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 3.5 m -51.12 -33.44 26.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.361 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.54 -47.3 55.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.867 0.365 . . . . 0.0 111.085 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -66.93 -27.99 73.62 Favored Glycine 0 C--O 1.229 -0.162 0 N-CA-C 110.169 -1.173 . . . . 0.0 110.169 177.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.722 HD13 HD11 ' A' ' 77' ' ' LEU . 2.3 mm? -71.32 -61.25 1.84 Allowed 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.328 -0.936 . . . . 0.0 110.159 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.779 ' O ' HG23 ' A' ' 20' ' ' VAL . 9.1 tttt -57.74 -36.78 72.54 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.37 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -63.95 -49.61 71.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.677 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.537 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -67.52 -42.53 82.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.956 -179.476 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.1 m -55.48 -50.13 70.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.001 0.429 . . . . 0.0 110.942 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.779 HG23 ' O ' ' A' ' 16' ' ' LYS . 24.7 t -66.47 -39.33 83.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.637 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.902 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 2.8 tp -64.27 -46.13 85.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.743 0.306 . . . . 0.0 111.462 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.607 HD23 ' CD2' ' A' ' 81' ' ' PHE . 0.7 OUTLIER -65.87 -42.35 90.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.05 -179.403 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -82.6 -17.96 42.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.911 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.43 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 13.3 tt0 -117.66 21.61 12.86 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -179.127 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.631 ' O ' HG23 ' A' ' 26' ' ' VAL . 0.6 OUTLIER -49.6 -67.35 0.27 Allowed 'General case' 0 C--N 1.331 -0.23 0 O-C-N 122.388 -0.195 . . . . 0.0 111.151 179.757 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' ' 25' ' ' GLN . 50.2 t 120.57 119.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.161 0.984 . . . . 0.0 110.667 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 . . . . . 0 C--N 1.331 -0.212 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.977 179.927 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.432 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.0 OUTLIER . . . . . 0 CA--C 1.523 -0.073 0 CA-C-O 120.985 0.421 . . . . 0.0 111.205 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.552 HG12 ' OH ' ' A' ' 85' ' ' TYR . 5.5 p -80.72 157.25 4.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.634 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.67 171.19 15.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.134 0.492 . . . . 0.0 111.5 -178.54 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.881 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -71.02 -32.0 68.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.28 -179.302 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.08 -35.98 82.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.013 0.435 . . . . 0.0 110.196 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.884 ' O ' HG23 ' A' ' 40' ' ' VAL . 6.2 t70 -70.7 -42.37 70.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.855 179.003 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.857 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -63.1 -44.79 94.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.815 179.13 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.881 HG23 ' O ' ' A' ' 34' ' ' GLU . 58.3 t -57.11 -47.27 84.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.699 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.402 ' CG2' ' N ' ' A' ' 40' ' ' VAL . 0.5 OUTLIER -63.52 -47.36 81.97 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.48 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 36' ' ' ASP . 41.7 t -59.33 -42.94 88.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.725 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.857 HG23 ' O ' ' A' ' 37' ' ' MET . 54.8 t -66.3 -48.6 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.476 179.513 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.08 -44.67 83.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.349 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.492 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -59.07 -48.42 81.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.435 179.506 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.902 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 32.5 m0 -60.84 -41.12 95.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.462 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.454 ' HG3' HD13 ' A' ' 74' ' ' LEU . 22.5 ttm -67.77 -43.0 80.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.64 -179.245 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -73.22 -33.26 65.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.987 0.422 . . . . 0.0 109.906 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.492 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -62.54 -41.89 99.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.856 179.151 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -70.65 -43.02 70.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.707 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.865 HD11 ' HB3' ' A' ' 71' ' ' ARG . 2.2 mm -56.23 -55.1 20.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.966 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.0 m-80 -68.36 -40.14 81.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.01 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.414 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.5 t80 -59.06 -53.66 55.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.722 ' CD1' HD13 ' A' ' 10' ' ' LEU . 23.5 m-85 -68.8 -28.52 66.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.405 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.754 ' HA ' HD21 ' A' ' 67' ' ' LEU . 42.2 ttm-85 -59.72 -28.96 67.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.07 0.462 . . . . 0.0 110.16 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.3 -9.42 19.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.792 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.793 ' HG3' HD11 ' A' ' 10' ' ' LEU . 11.6 tp60 -95.64 11.96 31.44 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -178.768 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.88 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -94.89 177.05 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.236 0.541 . . . . 0.0 111.615 -179.813 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 35.0 p -149.53 171.74 16.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.299 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 80.33 -173.98 54.93 Favored Glycine 0 CA--C 1.519 0.296 0 C-N-CA 120.241 -0.98 . . . . 0.0 114.015 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.426 ' O ' ' HD2' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -52.7 152.26 7.04 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.274 -0.463 . . . . 0.0 111.418 -179.172 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.484 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 14.1 Cg_endo -56.82 -33.35 94.34 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.121 2.547 . . . . 0.0 113.3 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.33 -43.17 98.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.134 0.492 . . . . 0.0 110.912 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.53 -46.77 86.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.642 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.88 ' HA ' HG11 ' A' ' 56' ' ' VAL . 0.4 OUTLIER -54.52 -51.88 63.75 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 121.036 0.445 . . . . 0.0 110.045 179.937 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.01 -42.07 75.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.058 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.503 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 25.1 tttm -61.96 -35.07 77.36 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 120.946 0.403 . . . . 0.0 110.989 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -70.68 -40.88 72.67 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.611 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.754 HD21 ' HA ' ' A' ' 53' ' ' ARG . 6.7 mp -70.24 -33.01 71.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.634 -179.616 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.53 ' HA ' ' HG2' ' A' ' 71' ' ' ARG . 12.1 pt20 -74.71 -48.3 26.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.836 0.35 . . . . 0.0 110.169 179.682 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.444 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 3.9 mm-40 -62.25 -34.03 75.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.491 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.466 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -68.94 -49.31 59.18 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.4 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.865 ' HB3' HD11 ' A' ' 49' ' ' ILE . 0.5 OUTLIER -55.48 -37.9 68.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.406 -179.999 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.54 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 36.8 mt-30 -71.56 -34.27 69.83 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -41.13 98.68 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.523 179.412 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 71' ' ' ARG . 5.4 mt -67.9 -45.15 75.21 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.22 0.533 . . . . 0.0 109.748 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -52.35 -41.93 63.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.662 -179.186 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.466 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 1.1 p -77.32 -50.58 12.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.584 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.722 HD11 HD13 ' A' ' 15' ' ' LEU . 4.0 mt -54.56 -37.73 65.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.068 -179.247 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.2 -27.39 59.58 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.088 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.57 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.4 t-20 -52.9 -50.29 82.36 Favored Pre-proline 0 CA--C 1.532 0.268 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.57 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 46.9 Cg_endo -68.8 -36.77 13.04 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.381 2.054 . . . . 0.0 112.609 -179.791 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.607 ' CD2' HD23 ' A' ' 22' ' ' LEU . 3.3 t80 -68.43 -54.42 17.22 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.008 0.433 . . . . 0.0 110.163 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 19.6 mt -57.15 -37.46 72.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.153 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.483 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -67.98 -40.74 83.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.848 0.356 . . . . 0.0 110.764 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 88' ' ' PHE . 0.1 OUTLIER -61.64 -39.63 91.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.038 0.447 . . . . 0.0 110.171 179.5 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.797 ' O ' HD13 ' A' ' 89' ' ' LEU . 1.2 t80 -77.53 -38.04 49.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.931 179.412 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.483 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 14.4 ptt180 -62.46 -47.95 81.78 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.11 -39.81 95.78 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.264 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.432 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 6.1 t80 -64.56 -28.45 69.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.742 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.797 HD13 ' O ' ' A' ' 85' ' ' TYR . 6.1 mp . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.899 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.504 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 120.682 0.277 . . . . 0.0 110.959 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -64.74 -42.04 95.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.93 0.395 . . . . 0.0 110.08 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.485 HD11 HE21 ' A' ' 55' ' ' GLN . 0.9 OUTLIER -63.14 -44.83 94.46 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.659 178.959 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.504 HD12 ' HA ' ' A' ' 8' ' ' LYS . 37.0 mt -60.52 -54.25 37.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.709 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.461 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 79.5 p -52.18 -41.98 63.08 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-O 120.828 0.347 . . . . 0.0 110.646 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.33 -40.91 83.36 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.033 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.459 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -68.62 -27.95 73.48 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 176.635 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.2 OUTLIER -71.22 -61.63 1.7 Allowed 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 114.478 -0.861 . . . . 0.0 111.166 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.589 ' O ' HG23 ' A' ' 20' ' ' VAL . 6.6 mmtm -59.19 -33.81 71.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.267 0.556 . . . . 0.0 109.951 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -62.69 -50.87 69.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.877 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.516 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -74.34 -41.75 60.55 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.849 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.409 ' HG ' ' HA ' ' A' ' 16' ' ' LYS . 80.2 p -62.27 -51.64 66.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.804 0.335 . . . . 0.0 110.662 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' ' 16' ' ' LYS . 54.2 t -65.86 -35.44 75.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.444 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.859 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 1.9 tp -68.9 -43.62 74.86 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.037 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.891 HD13 ' HB2' ' A' ' 81' ' ' PHE . 1.5 mt -69.41 -31.36 69.67 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.703 0.261 . . . . 0.0 111.703 -179.15 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -75.71 -28.94 58.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.484 ' C ' ' H ' ' A' ' 26' ' ' VAL . 4.1 mp0 -117.66 -51.53 2.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.324 0.583 . . . . 0.0 111.547 -179.454 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.859 ' HG3' ' O ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER 64.44 -36.18 0.18 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.778 179.074 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.505 HG23 ' C ' ' A' ' 25' ' ' GLN . 4.7 t 80.91 109.62 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.812 0.339 . . . . 0.0 110.359 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.517 ' CZ ' ' CE1' ' A' ' 85' ' ' TYR . 20.7 m-85 . . . . . 0 CA--C 1.513 -0.462 0 CA-C-O 121.754 0.788 . . . . 0.0 111.819 -178.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 mt . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 121.09 0.471 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.596 HG22 ' HB2' ' A' ' 36' ' ' ASP . 13.8 p -78.59 146.51 7.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.239 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.1 p -79.73 171.69 14.79 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.077 0.465 . . . . 0.0 112.006 -178.317 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.6 ' O ' HG23 ' A' ' 38' ' ' VAL . 4.3 tt0 -63.52 -48.09 78.98 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.317 -178.774 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -59.24 -33.4 70.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.516 0.674 . . . . 0.0 110.117 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.914 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.1 m-20 -73.22 -33.25 65.25 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.055 178.121 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.544 ' HG3' ' CD2' ' A' ' 85' ' ' TYR . 0.0 OUTLIER -67.43 -47.27 70.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.451 178.27 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 34' ' ' GLU . 38.8 t -55.7 -46.52 79.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.299 179.281 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -44.52 88.18 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.914 HG23 ' O ' ' A' ' 36' ' ' ASP . 45.4 t -57.96 -48.15 84.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.54 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 37' ' ' MET . 43.1 t -59.91 -48.73 86.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.655 179.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.47 ' OE1' HG12 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -55.05 -45.08 75.25 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.324 179.77 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.599 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -66.41 -43.59 85.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.029 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.627 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 8.3 m0 -62.25 -43.31 99.11 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.175 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.495 ' HA ' HD12 ' A' ' 74' ' ' LEU . 16.7 mtm -67.75 -43.62 79.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.044 -178.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -72.65 -34.87 67.57 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.235 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.599 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -65.91 -42.98 89.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.033 179.158 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -67.3 -48.32 67.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.847 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.533 HG22 ' N ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -59.58 -55.42 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.405 -179.484 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.533 ' N ' HG22 ' A' ' 49' ' ' ILE . 11.0 t30 -60.15 -41.16 92.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.967 0.413 . . . . 0.0 110.907 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.498 ' CG ' ' OE1' ' A' ' 55' ' ' GLN . 6.3 t80 -62.33 -50.97 69.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.717 -179.324 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.459 ' OH ' ' HA3' ' A' ' 14' ' ' GLY . 17.4 m-85 -64.79 -30.78 71.8 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -178.424 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.691 ' HA ' HD21 ' A' ' 67' ' ' LEU . 2.1 mtt180 -58.97 -21.53 58.75 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 119.923 -0.711 . . . . 0.0 110.447 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -100.7 -18.7 16.39 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.498 ' OE1' ' CG ' ' A' ' 51' ' ' TYR . 2.5 mt-30 -93.6 47.15 1.22 Allowed 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 120.83 -0.348 . . . . 0.0 111.141 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.904 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -128.82 165.84 27.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.312 0.577 . . . . 0.0 112.3 -179.633 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.82 171.74 14.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.204 -0.907 . . . . 0.0 108.867 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 83.7 -170.83 48.58 Favored Glycine 0 CA--C 1.516 0.154 0 C-N-CA 120.202 -0.999 . . . . 0.0 113.018 179.43 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.23 145.51 73.91 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-O 120.661 0.267 . . . . 0.0 111.067 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.518 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 12.0 Cg_endo -55.03 -19.96 21.84 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.931 2.421 . . . . 0.0 112.794 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.34 -40.75 77.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.798 0.332 . . . . 0.0 110.972 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.36 -47.01 71.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.39 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.904 ' HA ' HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -60.17 -50.75 72.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.462 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -54.58 -41.18 69.57 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.999 -179.033 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -60.48 -49.74 76.34 Favored 'General case' 0 CA--C 1.523 -0.078 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.113 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.444 ' O ' ' HG2' ' A' ' 69' ' ' GLU . . . -57.2 -39.61 75.76 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.78 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.691 HD21 ' HA ' ' A' ' 53' ' ' ARG . 3.6 mp -68.77 -37.98 79.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.12 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -70.81 -46.45 62.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.904 0.383 . . . . 0.0 110.271 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 66' ' ' ALA . 8.7 pt-20 -62.19 -35.93 80.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.108 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.466 ' HA ' HD22 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -63.33 -49.52 73.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.74 179.404 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.7 ttt-85 -55.46 -46.28 76.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.792 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.413 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -68.11 -38.35 82.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.15 0.5 . . . . 0.0 110.127 179.403 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 3.1 tp10 -64.47 -35.92 82.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.64 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 45' ' ' MET . 0.1 OUTLIER -68.55 -46.31 69.82 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.282 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -52.57 -39.24 61.32 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.956 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.524 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 6.8 t -80.86 -48.61 12.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.811 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.462 ' O ' HD12 ' A' ' 22' ' ' LEU . 2.0 mt -58.18 -40.72 82.22 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.25 75.93 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.298 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.537 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.6 m-80 -51.03 -50.37 75.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -177.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 55.6 Cg_endo -69.87 -27.7 25.63 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.377 2.051 . . . . 0.0 113.139 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.891 ' HB2' HD13 ' A' ' 22' ' ' LEU . 1.2 t80 -65.49 -53.58 40.52 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.686 0.279 . . . . 0.0 111.123 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 61.5 mt -53.39 -29.88 37.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.762 0.315 . . . . 0.0 110.441 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.89 -42.1 63.95 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -58.39 -43.19 88.43 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.564 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.544 ' CD2' ' HG3' ' A' ' 37' ' ' MET . 0.4 OUTLIER -72.38 -34.83 68.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.474 179.84 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -45.74 89.6 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.595 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -71.58 -30.02 65.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.921 178.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -70.34 -29.25 65.9 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.155 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.9 mm? . . . . . 0 C--N 1.33 -0.282 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.665 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.471 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.456 -0.17 0 CA-C-O 120.771 0.32 . . . . 0.0 111.015 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -71.55 -45.26 62.81 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.495 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.625 HD12 ' HD1' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -59.84 -46.64 88.61 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.327 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.628 HG13 HD21 ' A' ' 70' ' ' LEU . 3.7 tt -61.74 -53.73 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.828 179.208 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.484 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 8.0 t -57.38 -33.14 67.52 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-O 120.596 0.236 . . . . 0.0 111.478 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.29 78.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.287 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.457 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -71.74 -33.7 63.13 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 177.078 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.467 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.7 mm? -58.51 -61.16 2.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.093 -1.053 . . . . 0.0 109.51 178.5 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.732 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.4 OUTLIER -57.57 -35.48 70.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.219 0.533 . . . . 0.0 110.068 179.551 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.34 -48.57 80.7 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.536 179.31 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.527 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -70.57 -47.18 61.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.843 -179.944 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 89.3 p -55.49 -49.12 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.851 0.358 . . . . 0.0 110.709 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.732 HG23 ' O ' ' A' ' 16' ' ' LYS . 47.8 t -68.08 -31.72 53.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.597 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.947 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 6.2 tp -66.23 -45.69 79.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.825 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.754 HD22 ' CG ' ' A' ' 81' ' ' PHE . 8.2 mt -68.68 -38.93 80.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.222 -179.528 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.28 -27.37 32.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.823 0.344 . . . . 0.0 111.109 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.495 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -112.04 21.56 15.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.109 -179.783 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.66 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -66.25 37.25 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -179.199 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.66 ' O ' ' O ' ' A' ' 25' ' ' GLN . 6.1 m 15.24 125.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 179.281 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.413 ' HB3' ' CE2' ' A' ' 88' ' ' PHE . 17.8 m-85 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.319 178.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.2 mt . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.818 0.342 . . . . 0.0 110.971 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.555 HG12 ' OH ' ' A' ' 85' ' ' TYR . 9.6 p -73.42 142.29 15.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.31 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.0 t -79.86 172.5 13.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.154 0.502 . . . . 0.0 111.618 -178.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.893 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -66.52 -40.64 89.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.918 -179.017 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -66.16 -36.83 84.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.246 0.545 . . . . 0.0 110.246 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.898 ' O ' HG23 ' A' ' 40' ' ' VAL . 8.9 t0 -71.62 -35.47 70.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.485 178.766 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.823 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -68.37 -44.47 75.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.59 178.594 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 34' ' ' GLU . 60.9 t -56.25 -47.44 80.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.244 179.226 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -59.35 -46.74 87.79 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.049 179.262 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.898 HG23 ' O ' ' A' ' 36' ' ' ASP . 42.5 t -58.59 -44.59 89.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.532 179.466 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.823 HG23 ' O ' ' A' ' 37' ' ' MET . 30.9 t -62.98 -48.91 85.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.487 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.96 -44.11 70.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.49 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.474 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -67.63 -39.05 84.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.422 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.947 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 7.3 m0 -62.84 -44.98 94.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 53.2 mtm -67.13 -45.78 76.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.416 -178.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -66.52 -41.72 88.38 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.436 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.474 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.38 -43.35 92.91 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.875 179.177 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.507 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 7.1 m-85 -61.13 -52.0 66.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.61 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.521 HD12 ' HA ' ' A' ' 49' ' ' ILE . 0.2 OUTLIER -54.43 -55.17 16.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.228 -179.295 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.501 ' N ' HG22 ' A' ' 49' ' ' ILE . 28.7 t30 -64.74 -35.58 81.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.098 0.475 . . . . 0.0 110.234 179.231 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.458 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 6.3 t80 -64.8 -35.06 79.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.986 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.96 ' CD2' HD13 ' A' ' 70' ' ' LEU . 26.0 m-85 -75.78 -35.52 60.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.745 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.552 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.1 OUTLIER -60.65 -29.4 69.25 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.692 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -93.62 -14.8 26.04 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -178.344 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.543 ' HB3' HD21 ' A' ' 10' ' ' LEU . 2.1 mt-30 -104.89 43.72 1.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.812 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.564 ' HB ' ' CG ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -127.67 168.24 21.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.873 0.368 . . . . 0.0 111.02 178.982 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.6 p -139.4 171.25 14.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.825 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.65 -152.88 25.48 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.472 -0.871 . . . . 0.0 112.92 179.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.68 152.75 89.41 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-O 120.848 0.356 . . . . 0.0 111.163 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.515 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 43.7 Cg_endo -67.74 -22.33 43.58 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.737 2.291 . . . . 0.0 113.053 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -63.4 -42.02 98.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.668 -179.402 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.38 -39.73 81.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.257 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.564 ' CG ' ' HB ' ' A' ' 56' ' ' VAL . 1.2 mpt_? -59.32 -51.17 71.1 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.249 0.547 . . . . 0.0 109.595 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.97 -41.14 86.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.855 -179.577 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.502 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 9.9 tttp -68.04 -50.11 57.31 Favored 'General case' 0 C--N 1.338 0.092 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.585 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.61 -32.39 70.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.503 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.552 HD11 ' CB ' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -71.71 -40.17 69.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.435 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.534 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 3.0 pt20 -66.62 -36.84 83.56 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.534 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.2 tt0 -69.24 -35.09 75.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.002 179.259 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.96 HD13 ' CD2' ' A' ' 52' ' ' TYR . 4.0 mt -65.49 -49.27 69.68 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.45 -48.89 73.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.317 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.505 ' HG2' ' HA ' ' A' ' 69' ' ' GLU . 7.7 pt20 -64.14 -36.52 84.3 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 178.664 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 2.9 tp10 -63.08 -37.22 86.34 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.512 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.444 HD23 ' CE2' ' A' ' 18' ' ' PHE . 23.9 mt -68.16 -45.68 72.83 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.3 m120 -52.95 -38.46 62.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.863 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.441 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 5.6 t -80.86 -49.3 11.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.508 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.8 mt -56.44 -35.25 67.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.205 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.62 -31.67 62.06 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.558 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.2 t-20 -51.65 -50.16 78.81 Favored Pre-proline 0 CA--C 1.533 0.319 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.558 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 55.5 Cg_endo -69.84 -32.33 18.43 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.442 2.095 . . . . 0.0 113.119 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.754 ' CG ' HD22 ' A' ' 22' ' ' LEU . 6.2 t80 -65.89 -53.67 36.6 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.886 0.374 . . . . 0.0 110.914 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.6 mt -56.33 -31.31 63.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.756 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.421 ' O ' ' HG3' ' A' ' 86' ' ' ARG . . . -69.08 -46.18 68.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.834 0.35 . . . . 0.0 110.392 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -58.02 -42.47 85.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.698 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.555 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.5 OUTLIER -73.03 -33.55 65.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.0 -179.933 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.51 ' HG3' ' N ' ' A' ' 87' ' ' ASP . 0.0 OUTLIER -63.03 -39.4 94.62 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.935 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.51 ' N ' ' HG3' ' A' ' 86' ' ' ARG . 6.7 m-20 -72.8 -32.44 65.56 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.029 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.413 ' CE2' ' HB3' ' A' ' 27' ' ' PHE . 7.7 t80 -71.14 -28.92 64.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.713 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.456 179.165 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.5 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.772 0.32 . . . . 0.0 110.954 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.87 -45.25 52.11 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.47 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.506 HD11 ' HG3' ' A' ' 55' ' ' GLN . 10.6 tp -61.63 -46.38 90.03 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.106 0.479 . . . . 0.0 109.713 178.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.611 HD11 ' HG3' ' A' ' 69' ' ' GLU . 2.6 tt -61.36 -53.6 46.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.648 179.009 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.492 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 6.6 t -52.12 -33.09 38.33 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.909 0.385 . . . . 0.0 110.554 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -67.79 -41.72 82.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.75 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.533 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -70.88 -35.98 65.56 Favored Glycine 0 C--O 1.23 -0.141 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mp -59.75 -61.01 2.93 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 113.829 -1.186 . . . . 0.0 109.929 179.129 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.711 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.3 tptp -59.06 -37.09 76.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.229 0.538 . . . . 0.0 110.253 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 6.7 tp10 -61.3 -46.85 88.58 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.386 179.203 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.478 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.3 OUTLIER -71.12 -49.32 45.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.1 -179.781 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 91.3 p -55.85 -46.36 78.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.907 0.385 . . . . 0.0 110.419 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.711 HG23 ' O ' ' A' ' 16' ' ' LYS . 63.0 t -68.32 -32.91 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.392 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.66 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 6.6 tp -62.62 -45.98 90.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.793 0.33 . . . . 0.0 110.587 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.911 HD22 ' CG ' ' A' ' 81' ' ' PHE . 9.8 mt -72.95 -30.59 63.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.612 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -82.66 -30.14 29.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.542 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.491 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 5.4 mp0 -107.91 9.92 28.61 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -48.38 160.22 0.17 Allowed 'General case' 0 C--O 1.232 0.184 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 177.229 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 11.3 p -112.08 138.14 42.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 119.931 1.241 . . . . 0.0 110.158 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.455 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.4 m-85 . . . . . 0 C--N 1.326 -0.454 0 CA-C-O 121.524 0.678 . . . . 0.0 110.591 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.55 HD22 ' HE2' ' A' ' 88' ' ' PHE . 18.2 mt . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.911 0.386 . . . . 0.0 110.817 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.406 HG12 ' OH ' ' A' ' 85' ' ' TYR . 7.2 p -73.15 140.38 17.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.777 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.7 p -80.04 173.77 12.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.107 0.48 . . . . 0.0 111.856 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.907 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -62.81 -44.38 96.32 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.082 -179.106 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.32 -36.89 84.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.124 0.488 . . . . 0.0 110.542 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.911 ' O ' HG23 ' A' ' 40' ' ' VAL . 2.4 m-20 -71.55 -36.49 70.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.343 178.656 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.418 ' O ' HG23 ' A' ' 41' ' ' VAL . 5.3 tpt -66.91 -45.0 79.31 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.436 178.433 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.907 HG23 ' O ' ' A' ' 34' ' ' GLU . 77.8 t -55.6 -45.91 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.16 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.026 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -45.45 91.1 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.049 0.452 . . . . 0.0 109.865 178.796 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.911 HG23 ' O ' ' A' ' 36' ' ' ASP . 36.7 t -55.64 -47.66 78.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.015 179.667 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 37' ' ' MET . 39.4 t -68.41 -41.69 83.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.799 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -56.24 -47.17 79.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.975 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.549 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 2.8 p30 -71.56 -34.66 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.246 179.539 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.66 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 2.5 m0 -61.76 -46.61 88.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.418 0.627 . . . . 0.0 110.26 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.474 ' HG2' ' N ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -70.91 -36.6 72.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.125 -178.918 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.474 ' N ' ' HG2' ' A' ' 45' ' ' MET . 5.0 t30 -73.6 -39.83 64.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.959 0.409 . . . . 0.0 109.936 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.549 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.88 -45.76 91.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.728 179.438 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.468 ' CE1' ' CZ ' ' A' ' 47' ' ' PHE . 6.8 m-85 -64.71 -46.23 83.19 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.644 179.753 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.43 HG22 HH12 ' A' ' 53' ' ' ARG . 3.5 mm -55.18 -55.17 17.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.147 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -68.76 -37.69 79.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.955 0.407 . . . . 0.0 110.921 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.446 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.7 t80 -61.93 -43.07 99.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.91 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.694 ' O ' HG22 ' A' ' 56' ' ' VAL . 24.0 m-85 -75.66 -30.86 59.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.94 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.651 ' HG3' HD21 ' A' ' 67' ' ' LEU . 27.0 ttm105 -61.57 -30.53 70.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.998 0.428 . . . . 0.0 110.411 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -103.49 -10.97 18.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.397 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.506 ' HG3' HD11 ' A' ' 10' ' ' LEU . 9.5 tp-100 -96.33 21.85 8.53 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.641 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.729 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -102.12 174.06 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.138 0.494 . . . . 0.0 111.638 -179.599 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.0 p -143.8 171.43 14.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.433 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 83.66 -151.74 28.15 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.302 -0.951 . . . . 0.0 113.08 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.458 ' O ' ' HD3' ' A' ' 63' ' ' ARG . 13.8 mm-40 -75.15 159.45 82.5 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-O 120.726 0.298 . . . . 0.0 111.158 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.435 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 42.2 Cg_endo -67.6 -29.06 37.22 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.794 2.329 . . . . 0.0 113.861 -178.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.538 ' HG2' ' N ' ' A' ' 62' ' ' GLU . 8.8 pm0 -66.16 -39.13 89.54 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.945 0.403 . . . . 0.0 111.021 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.538 ' N ' ' HG2' ' A' ' 61' ' ' GLN . 18.3 mt-10 -64.17 -46.68 82.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.19 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.729 ' HA ' HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.61 -50.89 68.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.222 0.534 . . . . 0.0 109.611 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -55.46 -41.68 73.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.67 -178.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.434 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 8.5 mttt -61.69 -49.93 74.52 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.477 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.425 ' HA ' ' HG2' ' A' ' 69' ' ' GLU . . . -57.4 -35.84 70.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.857 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.651 HD21 ' HG3' ' A' ' 53' ' ' ARG . 6.6 mp -68.78 -37.93 79.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.434 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.435 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 0.0 OUTLIER -70.68 -43.82 68.29 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 179.538 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.611 ' HG3' HD11 ' A' ' 11' ' ' ILE . 9.1 pt-20 -67.65 -26.55 66.28 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.244 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.424 HD22 ' HA ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -69.55 -49.49 53.85 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.443 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.39 -48.84 73.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.785 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.49 -33.88 73.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.164 0.507 . . . . 0.0 109.88 179.129 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -58.86 -48.23 82.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.656 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.481 HD23 ' N ' ' A' ' 74' ' ' LEU . 4.6 mt -67.45 -42.96 82.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.983 0.42 . . . . 0.0 110.341 178.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -52.29 -40.83 62.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.915 -179.136 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.7 m -81.0 -50.7 9.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.156 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.423 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 0.5 OUTLIER -57.0 -34.57 68.27 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.355 -179.07 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.3 -30.09 60.26 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 -178.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.567 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -51.74 -49.74 81.56 Favored Pre-proline 0 CA--C 1.535 0.389 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.237 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.567 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.5 Cg_endo -69.54 -36.63 11.04 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.416 2.077 . . . . 0.0 113.235 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.911 ' CG ' HD22 ' A' ' 22' ' ' LEU . 13.6 t80 -65.04 -53.63 42.86 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.992 0.425 . . . . 0.0 110.415 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 20.1 mt -58.2 -29.43 65.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.588 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -66.41 -48.87 68.68 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 110.155 179.203 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -57.21 -49.14 76.93 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.567 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.406 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -67.74 -33.41 74.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.693 179.854 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.69 -38.07 88.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.163 0.506 . . . . 0.0 109.654 178.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.84 -31.08 64.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.739 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.55 ' HE2' HD22 ' A' ' 31' ' ' LEU . 9.1 t80 -73.23 -37.25 66.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.452 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.131 178.69 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.788 0.327 . . . . 0.0 110.734 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -70.63 -45.15 65.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.598 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.82 HD11 ' CG ' ' A' ' 55' ' ' GLN . 0.3 OUTLIER -60.07 -46.18 90.44 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.273 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.74 HG22 HD12 ' A' ' 15' ' ' LEU . 41.1 mm -61.82 -54.28 36.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.079 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.0 t -61.31 -33.07 72.99 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.69 -43.93 75.04 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.945 -179.051 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.695 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -70.85 -42.3 61.05 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 177.255 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.74 HD12 HG22 ' A' ' 11' ' ' ILE . 2.1 mt -54.34 -58.7 6.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 113.813 -1.193 . . . . 0.0 109.745 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.533 ' O ' HG23 ' A' ' 20' ' ' VAL . 48.7 tttm -61.77 -31.97 72.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.139 0.495 . . . . 0.0 109.851 179.318 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.49 -48.54 80.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.252 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.792 ' CE2' HD23 ' A' ' 74' ' ' LEU . 0.5 OUTLIER -72.82 -50.24 25.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.754 -179.904 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.435 ' HA ' HD12 ' A' ' 22' ' ' LEU . 11.1 m -55.41 -51.31 67.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.987 0.423 . . . . 0.0 110.173 179.619 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 16' ' ' LYS . 95.6 t -65.03 -32.39 58.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.233 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.601 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 3.7 tp -64.19 -45.92 86.22 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.612 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.559 HD22 ' HB2' ' A' ' 81' ' ' PHE . 1.7 mt -66.65 -36.01 81.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.008 0.432 . . . . 0.0 110.129 179.683 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -82.59 -18.18 42.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.188 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.405 ' N ' ' O ' ' A' ' 20' ' ' VAL . 22.1 mt-30 -107.48 12.24 28.03 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.502 ' HG3' ' CZ ' ' A' ' 81' ' ' PHE . 1.9 mm-40 -50.14 161.97 0.24 Allowed 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 178.003 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.5 t -109.23 132.08 58.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 119.107 0.867 . . . . 0.0 111.102 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.412 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 5.4 m-85 . . . . . 0 C--N 1.323 -0.584 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.71 179.303 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.4 mt . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.98 0.419 . . . . 0.0 111.335 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.423 HG12 ' OH ' ' A' ' 85' ' ' TYR . 10.2 p -73.88 154.23 6.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.84 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.81 170.06 17.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.253 0.549 . . . . 0.0 112.117 -178.276 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.887 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -68.3 -29.52 68.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.591 -179.2 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -34.06 76.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.077 0.465 . . . . 0.0 110.279 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.882 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.3 OUTLIER -71.7 -40.78 69.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.917 179.232 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.807 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -64.63 -45.59 86.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.754 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 34' ' ' GLU . 48.1 t -55.66 -48.16 78.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.875 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.41 HG22 ' O ' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -62.23 -44.86 95.6 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.228 179.638 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.882 HG23 ' O ' ' A' ' 36' ' ' ASP . 53.4 t -59.05 -43.61 89.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.684 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.807 HG23 ' O ' ' A' ' 37' ' ' MET . 35.6 t -67.08 -48.83 77.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.57 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -50.86 71.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.381 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.51 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.7 OUTLIER -60.14 -41.64 93.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.168 179.316 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.601 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 8.4 m0 -60.75 -43.75 97.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.409 179.372 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.586 ' HG3' HD13 ' A' ' 74' ' ' LEU . 0.4 OUTLIER -61.54 -50.67 71.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.228 -178.954 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -68.32 -36.84 79.9 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.51 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.75 -41.15 90.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.783 179.177 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.468 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 4.8 m-85 -70.78 -48.37 54.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.835 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.451 HD13 ' HA ' ' A' ' 49' ' ' ILE . 4.5 mm -53.86 -55.05 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.302 -179.001 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -68.65 -34.52 75.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.838 0.352 . . . . 0.0 110.966 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.454 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 3.0 t80 -65.36 -44.34 87.95 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.938 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.716 ' O ' HG22 ' A' ' 56' ' ' VAL . 58.8 m-85 -75.43 -33.39 60.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.59 -179.426 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.794 ' HA ' HD11 ' A' ' 67' ' ' LEU . 29.7 ttm-85 -61.38 -31.22 71.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.664 0.269 . . . . 0.0 111.476 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -96.2 -9.54 30.24 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.82 ' CG ' HD11 ' A' ' 10' ' ' LEU . 4.0 pt20 -113.48 35.47 4.01 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -178.602 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.716 HG22 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -111.75 156.33 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 177.786 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.4 p -122.25 169.84 10.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.82 0.343 . . . . 0.0 110.883 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 91.19 -152.35 21.58 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.505 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.95 163.73 66.19 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 120.765 0.316 . . . . 0.0 110.885 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.44 -27.72 39.58 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.616 2.21 . . . . 0.0 112.547 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.07 -41.91 94.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.96 0.409 . . . . 0.0 110.92 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.77 -46.65 84.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.467 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.469 ' HD3' ' HB ' ' A' ' 56' ' ' VAL . 17.4 mtt85 -55.32 -51.18 67.58 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.255 0.55 . . . . 0.0 109.865 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -55.83 -41.45 74.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.541 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -60.18 -49.9 75.79 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.06 0.457 . . . . 0.0 110.3 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.19 68.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.413 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.794 HD11 ' HA ' ' A' ' 53' ' ' ARG . 4.5 mp -67.5 -39.98 85.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.401 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -70.29 -45.67 65.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.123 0.487 . . . . 0.0 110.012 179.458 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.435 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 2.7 mt-10 -62.87 -32.93 74.27 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.239 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.691 HD11 ' CE2' ' A' ' 52' ' ' TYR . 0.3 OUTLIER -65.97 -49.32 68.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.148 0.499 . . . . 0.0 109.683 179.247 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.419 ' HA ' HD12 ' A' ' 74' ' ' LEU . 2.3 tmm_? -55.26 -46.18 76.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.728 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.463 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -69.43 -31.89 70.51 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.089 0.471 . . . . 0.0 110.068 179.09 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.463 ' N ' ' HG3' ' A' ' 72' ' ' GLN . 1.0 OUTLIER -61.82 -45.97 91.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.839 179.584 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.792 HD23 ' CE2' ' A' ' 18' ' ' PHE . 1.8 mt -67.36 -44.69 78.39 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 121.157 0.503 . . . . 0.0 110.315 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 26.6 m120 -52.46 -41.2 63.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.855 -179.357 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.402 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -80.84 -50.56 9.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.037 179.615 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.513 HD22 ' CD1' ' A' ' 22' ' ' LEU . 4.7 mt -56.21 -34.58 66.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.062 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.08 -28.98 61.64 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.806 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.569 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 10.6 t30 -53.84 -50.28 84.67 Favored Pre-proline 0 C--N 1.328 -0.333 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.3 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 42.1 Cg_endo -68.29 -39.37 10.16 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.474 2.116 . . . . 0.0 113.222 -179.358 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.559 ' HB2' HD22 ' A' ' 22' ' ' LEU . 5.7 t80 -63.81 -53.53 49.35 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.231 0.538 . . . . 0.0 110.565 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.441 HD21 HG21 ' A' ' 41' ' ' VAL . 88.3 mt -57.57 -31.5 66.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.794 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.477 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -68.3 -45.2 73.66 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.961 0.41 . . . . 0.0 110.772 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -59.62 -41.86 91.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.059 0.457 . . . . 0.0 110.587 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.438 ' O ' ' HG ' ' A' ' 89' ' ' LEU . 0.2 OUTLIER -77.57 -35.71 52.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.691 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 22.3 ptt180 -64.17 -39.49 94.12 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.568 -0.453 . . . . 0.0 109.819 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.59 -36.99 68.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.72 178.807 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -69.6 -29.24 66.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.486 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 85' ' ' TYR . 6.2 mt . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.479 178.412 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.814 0.34 . . . . 0.0 110.551 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.77 -44.51 89.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.086 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.493 HD22 ' HA ' ' A' ' 10' ' ' LEU . 0.3 OUTLIER -59.91 -46.54 89.04 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.226 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.747 HD13 ' HE2' ' A' ' 52' ' ' TYR . 35.3 mm -57.79 -53.75 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.821 178.773 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.508 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 25.1 p -53.0 -42.87 66.02 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.285 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.4 91.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.557 0.218 . . . . 0.0 111.261 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.458 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.91 -28.03 72.38 Favored Glycine 0 CA--C 1.518 0.227 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 177.219 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.577 HD12 HG22 ' A' ' 11' ' ' ILE . 0.4 OUTLIER -67.35 -61.48 1.89 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.211 -0.994 . . . . 0.0 110.691 179.452 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.761 ' O ' HG23 ' A' ' 20' ' ' VAL . 5.1 mmtt -59.69 -39.18 83.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.308 0.575 . . . . 0.0 109.634 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -59.37 -50.64 73.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.956 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.534 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -69.85 -42.7 73.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.985 -179.756 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.46 -51.06 71.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.991 0.424 . . . . 0.0 110.426 179.462 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.761 HG23 ' O ' ' A' ' 16' ' ' LYS . 61.1 t -63.29 -33.55 61.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.657 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.953 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 34.9 tp -62.37 -46.14 89.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.826 0.346 . . . . 0.0 110.777 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.832 HD22 ' CG ' ' A' ' 81' ' ' PHE . 36.7 mt -66.25 -41.29 90.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.073 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -80.03 -21.21 43.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.429 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.484 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -117.55 21.48 12.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.223 -179.691 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.653 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.1 OUTLIER -66.93 36.55 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.118 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.653 ' O ' ' O ' ' A' ' 25' ' ' GLN . 22.4 m 8.45 127.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 . . . . . 0 C--N 1.328 -0.366 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.211 178.606 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.415 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.0 OUTLIER . . . . . 0 N--CA 1.462 0.153 0 CA-C-O 121.049 0.452 . . . . 0.0 112.172 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.597 HG12 ' OH ' ' A' ' 85' ' ' TYR . 11.1 p -76.46 152.67 5.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.024 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.0 m -79.97 172.19 14.1 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.204 0.526 . . . . 0.0 111.912 -178.546 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.91 ' O ' HG23 ' A' ' 38' ' ' VAL . 2.0 mp0 -66.64 -40.74 88.84 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.221 -178.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -37.01 85.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.109 0.48 . . . . 0.0 110.461 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.883 ' O ' HG23 ' A' ' 40' ' ' VAL . 5.0 m-20 -71.91 -35.73 69.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.511 178.831 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.601 ' O ' HG23 ' A' ' 41' ' ' VAL . 5.5 tpt -67.16 -45.55 76.7 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.506 178.594 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.91 HG23 ' O ' ' A' ' 34' ' ' GLU . 49.1 t -55.67 -46.74 79.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.232 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -46.87 85.01 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.162 179.084 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 36' ' ' ASP . 25.5 t -55.83 -51.52 59.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.651 179.367 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 37' ' ' MET . 32.0 t -58.08 -46.42 88.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.544 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.71 -47.09 74.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.466 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.544 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 1.0 OUTLIER -56.83 -48.58 77.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.948 179.833 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.953 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 33.2 m0 -60.76 -42.27 97.12 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.122 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.709 ' HG3' HD13 ' A' ' 74' ' ' LEU . 2.9 ttp -61.86 -50.96 70.17 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.196 -0.457 . . . . 0.0 112.042 -178.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -72.62 -29.6 63.61 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.017 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.544 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 1.1 t80 -64.02 -45.47 88.78 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.832 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -69.49 -42.62 74.53 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.306 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 15.1 mm -54.14 -55.29 15.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.197 -179.609 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.547 ' HA ' ' HG2' ' A' ' 53' ' ' ARG . 13.0 m-80 -66.64 -34.87 78.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.301 0.572 . . . . 0.0 110.171 179.397 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.479 ' HB2' ' O ' ' A' ' 47' ' ' PHE . 6.6 t80 -62.78 -40.22 96.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.044 179.715 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.934 ' O ' HG23 ' A' ' 56' ' ' VAL . 5.3 m-85 -75.47 -38.71 59.43 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -178.781 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.547 ' HG2' ' HA ' ' A' ' 50' ' ' ASN . 4.8 ptp85 -58.75 -31.64 68.52 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.122 -179.393 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -91.49 -11.38 37.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.591 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.469 ' HG2' ' CE1' ' A' ' 51' ' ' TYR . 2.5 mp0 -96.58 -18.62 19.64 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.134 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.934 HG23 ' O ' ' A' ' 52' ' ' TYR . 14.5 t -68.78 160.39 4.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.08 0.467 . . . . 0.0 111.886 -179.257 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.537 ' N ' HG12 ' A' ' 56' ' ' VAL . 19.4 p -133.88 171.11 14.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.509 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 90.9 -151.08 20.95 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.934 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.401 ' O ' ' HD2' ' A' ' 63' ' ' ARG . 0.5 OUTLIER -78.11 162.91 65.25 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.707 0.289 . . . . 0.0 110.984 -179.853 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -60.98 -28.34 86.14 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.715 2.277 . . . . 0.0 112.761 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -43.29 99.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.131 0.491 . . . . 0.0 110.679 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.23 -46.66 88.99 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.211 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.613 ' HG3' ' HB ' ' A' ' 56' ' ' VAL . 3.7 mpt_? -54.04 -51.19 64.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.05 0.452 . . . . 0.0 110.014 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.43 -41.97 73.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.314 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.421 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 2.2 ttmm -66.66 -32.06 73.14 Favored 'General case' 0 CA--C 1.523 -0.069 0 O-C-N 122.082 -0.386 . . . . 0.0 110.852 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -71.07 -38.33 72.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.464 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.541 HD21 ' HB3' ' A' ' 53' ' ' ARG . 8.9 mp -70.03 -35.05 74.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.588 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 3.3 pp0? -73.81 -46.35 45.81 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.373 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -62.34 -35.65 79.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.522 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.441 HD21 ' CD1' ' A' ' 52' ' ' TYR . 2.1 tp -66.09 -49.02 69.02 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.111 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -55.23 -45.65 75.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.796 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.04 -33.53 65.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.041 0.448 . . . . 0.0 110.056 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.447 ' O ' HG22 ' A' ' 76' ' ' THR . 0.4 OUTLIER -60.77 -48.0 83.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.752 179.808 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.709 HD13 ' HG3' ' A' ' 45' ' ' MET . 4.5 mt -67.67 -44.8 76.96 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.931 0.396 . . . . 0.0 110.535 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -52.69 -40.17 62.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.326 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.447 HG22 ' O ' ' A' ' 73' ' ' GLU . 12.1 t -80.87 -34.73 33.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.265 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.431 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 0.6 OUTLIER -72.97 -30.16 63.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.996 -179.276 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.26 -29.4 60.16 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.157 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.569 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 15.3 m-20 -54.76 -50.23 87.06 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.2 Cg_endo -69.78 -37.87 8.52 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.459 2.106 . . . . 0.0 112.74 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.832 ' CG ' HD22 ' A' ' 22' ' ' LEU . 1.8 t80 -62.75 -53.42 54.58 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 110.415 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 93.2 mt -55.03 -27.64 46.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.283 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.47 -45.46 62.49 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.457 179.265 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 80' ' ' PRO . 7.6 mttt -56.86 -42.94 80.65 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.146 0.498 . . . . 0.0 109.925 179.267 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.597 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.2 OUTLIER -75.34 -33.39 61.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.445 179.143 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -44.49 96.28 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.24 -33.55 69.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.007 178.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.415 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 2.9 t80 -71.49 -28.91 64.24 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.017 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.739 HD12 ' OE1' ' A' ' 34' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.421 179.287 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 120.803 0.335 . . . . 0.0 110.568 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -65.15 -42.63 93.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.155 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.967 HD13 ' CE2' ' A' ' 52' ' ' TYR . 0.2 OUTLIER -59.72 -48.22 82.53 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.717 179.324 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.642 HG22 HD13 ' A' ' 15' ' ' LEU . 41.0 mm -59.13 -53.79 43.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.073 178.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 72.3 m -57.21 -33.11 67.18 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.011 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.17 91.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.183 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.508 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.75 -41.87 72.7 Favored Glycine 0 CA--C 1.511 -0.201 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 177.149 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.642 HD13 HG22 ' A' ' 11' ' ' ILE . 0.9 OUTLIER -54.4 -58.9 5.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 113.824 -1.188 . . . . 0.0 109.624 178.824 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.707 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -59.68 -30.92 69.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.373 179.465 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.33 -47.26 74.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.449 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.553 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -71.32 -46.11 61.42 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.71 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 82.9 p -55.51 -51.6 66.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 0.0 110.749 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.707 HG23 ' O ' ' A' ' 16' ' ' LYS . 48.3 t -66.59 -33.27 62.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.967 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.883 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 2.6 tp -66.76 -45.78 77.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.01 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.784 HD22 ' HB2' ' A' ' 81' ' ' PHE . 4.5 mt -68.23 -35.11 77.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.855 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.47 -34.24 31.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.91 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.66 ' O ' HG23 ' A' ' 26' ' ' VAL . 4.8 tt0 -104.8 18.81 21.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.233 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.497 ' O ' HG23 ' A' ' 26' ' ' VAL . 0.0 OUTLIER -39.37 -59.37 1.08 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.762 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 24' ' ' GLN . 42.4 t 98.92 130.19 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.534 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.448 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.1 m-85 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.979 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.499 HD22 ' HE2' ' A' ' 88' ' ' PHE . 3.9 mt . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.963 0.411 . . . . 0.0 111.114 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 11.6 p -74.55 144.92 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.825 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.86 173.36 12.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.085 0.469 . . . . 0.0 111.734 -178.68 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.88 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.1 OUTLIER -64.61 -42.81 95.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.141 -179.121 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -66.07 -37.25 85.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.071 0.462 . . . . 0.0 110.756 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.874 ' O ' HG23 ' A' ' 40' ' ' VAL . 3.9 m-20 -71.57 -37.84 71.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.819 179.046 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.765 ' O ' HG23 ' A' ' 41' ' ' VAL . 1.4 tpt -67.91 -45.14 75.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.704 178.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 34' ' ' GLU . 96.1 t -56.41 -44.14 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.448 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -45.57 92.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.924 0.392 . . . . 0.0 110.142 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.874 HG23 ' O ' ' A' ' 36' ' ' ASP . 39.2 t -60.11 -44.23 94.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.533 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.765 HG23 ' O ' ' A' ' 37' ' ' MET . 38.8 t -65.06 -49.11 81.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.62 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.83 -42.94 80.54 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.237 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.402 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -60.26 -41.0 92.33 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.071 0.462 . . . . 0.0 109.774 179.022 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.883 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 10.7 m0 -60.52 -39.35 87.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.249 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.524 ' HA ' HD12 ' A' ' 74' ' ' LEU . 52.0 mtm -68.07 -45.99 72.3 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -178.579 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.02 -34.35 73.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.03 0.443 . . . . 0.0 110.07 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.449 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -62.8 -46.19 89.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.098 179.32 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -66.61 -47.39 72.79 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.12 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.43 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.3 OUTLIER -55.31 -55.09 18.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.027 -179.681 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.496 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 8.0 m-80 -66.68 -36.85 83.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.131 0.491 . . . . 0.0 110.727 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.449 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 4.7 t80 -64.65 -39.27 93.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.142 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.967 ' CE2' HD13 ' A' ' 10' ' ' LEU . 7.5 m-85 -75.64 -36.75 60.1 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.815 ' HB3' HD21 ' A' ' 67' ' ' LEU . 8.8 ptp180 -58.13 -28.48 64.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.089 0.471 . . . . 0.0 110.8 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -95.49 -8.57 34.91 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.596 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 29.3 tp60 -95.7 -7.83 36.3 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.698 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.634 ' HB ' ' HD2' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -85.14 178.29 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.172 0.511 . . . . 0.0 111.715 -178.962 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.0 p -144.91 171.4 14.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.288 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.85 -144.85 19.72 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.901 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -79.17 163.69 58.48 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.724 0.297 . . . . 0.0 110.975 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.474 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 45.4 Cg_endo -67.7 -22.74 43.22 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.666 2.244 . . . . 0.0 112.777 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.17 -43.13 92.71 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.938 0.399 . . . . 0.0 110.733 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -60.82 -44.58 96.73 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.081 179.44 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.634 ' HD2' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.52 -50.96 68.6 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.225 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -55.28 -41.94 72.95 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.535 -178.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.461 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 0.8 OUTLIER -66.33 -34.41 77.93 Favored 'General case' 0 C--O 1.231 0.101 0 O-C-N 122.103 -0.373 . . . . 0.0 110.955 -179.819 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.487 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -69.48 -38.48 77.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.089 0.471 . . . . 0.0 110.032 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.815 HD21 ' HB3' ' A' ' 53' ' ' ARG . 8.1 mp -68.45 -35.94 78.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.395 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 18.8 pt20 -76.08 -48.91 19.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.811 0.338 . . . . 0.0 110.815 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.44 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.2 mt-10 -61.98 -41.98 98.63 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.519 -179.543 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.551 HD22 ' CD2' ' A' ' 52' ' ' TYR . 9.5 tp -66.68 -49.1 67.2 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.73 -43.27 76.44 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.431 179.531 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.4 -41.25 76.67 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.158 0.504 . . . . 0.0 109.65 179.111 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 3.2 tp10 -58.55 -39.41 80.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.601 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.524 HD12 ' HA ' ' A' ' 45' ' ' MET . 1.3 mt -67.98 -45.53 73.91 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.202 0.525 . . . . 0.0 109.813 178.149 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -52.52 -37.19 56.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.563 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.425 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -80.83 -50.6 9.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.69 179.148 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.474 HD22 ' CD1' ' A' ' 22' ' ' LEU . 3.8 mt -57.81 -35.02 70.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.506 -178.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.16 -30.89 60.86 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.565 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.0 OUTLIER -51.52 -49.97 79.48 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.086 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.565 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 51.1 Cg_endo -69.4 -34.1 16.52 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.43 2.087 . . . . 0.0 112.961 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.784 ' HB2' HD22 ' A' ' 22' ' ' LEU . 3.3 t80 -66.97 -53.85 27.64 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.902 0.382 . . . . 0.0 110.22 179.649 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 90.6 mt -60.6 -27.57 67.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.783 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.529 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -70.25 -42.67 71.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.051 0.453 . . . . 0.0 110.465 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.69 -42.9 94.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.299 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -72.66 -42.71 64.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.519 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.529 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 9.1 ptm180 -59.84 -35.4 74.67 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.449 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.55 -35.32 67.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.343 178.141 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.499 ' HE2' HD22 ' A' ' 31' ' ' LEU . 15.1 t80 -69.89 -28.55 65.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.004 179.198 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.6 mm? . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.141 179.202 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.639 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.733 0.301 . . . . 0.0 110.713 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.92 -45.0 83.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.48 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.473 HD21 ' HD1' ' A' ' 52' ' ' TYR . 2.7 tp -60.81 -46.09 91.88 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.211 0.529 . . . . 0.0 109.691 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.639 HD12 ' HA ' ' A' ' 8' ' ' LYS . 12.9 mt -60.48 -53.81 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.962 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.435 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 4.1 m -55.2 -33.65 63.22 Favored 'General case' 0 C--O 1.227 -0.107 0 CA-C-O 120.912 0.387 . . . . 0.0 110.468 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.06 -41.34 95.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.588 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.494 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -70.39 -40.41 69.09 Favored Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 109.126 -1.59 . . . . 0.0 109.126 176.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.605 HD13 HG22 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -54.64 -60.02 3.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.908 -1.146 . . . . 0.0 110.454 179.135 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.665 ' O ' HG23 ' A' ' 20' ' ' VAL . 15.7 tttm -60.8 -34.65 74.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.164 0.507 . . . . 0.0 110.092 179.723 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.44 -47.76 84.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.214 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.563 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -69.81 -50.31 44.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.852 -179.76 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.612 ' HA ' HD12 ' A' ' 22' ' ' LEU . 61.6 m -55.44 -51.6 66.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.05 0.452 . . . . 0.0 110.836 179.871 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.665 HG23 ' O ' ' A' ' 16' ' ' LYS . 58.3 t -63.66 -33.76 63.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.646 179.598 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.88 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 1.0 OUTLIER -66.24 -45.95 78.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.647 179.878 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.821 HD22 ' HB2' ' A' ' 81' ' ' PHE . 2.6 mt -61.93 -37.75 85.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.015 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -82.52 -19.29 38.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.034 179.257 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.432 ' HG3' ' HA ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -109.58 21.28 17.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.425 -179.683 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.801 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.8 OUTLIER -74.31 29.45 0.08 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.295 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.801 ' O ' ' O ' ' A' ' 25' ' ' GLN . 22.9 t 19.78 133.31 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 N-CA-C 113.815 1.042 . . . . 0.0 113.815 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 . . . . . 0 C--N 1.33 -0.241 0 CA-C-O 121.245 0.545 . . . . 0.0 110.804 178.854 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.455 HD21 ' HE2' ' A' ' 88' ' ' PHE . 9.8 mt . . . . . 0 N--CA 1.456 -0.144 0 CA-C-O 121.037 0.446 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.529 HG12 ' OH ' ' A' ' 85' ' ' TYR . 11.5 p -74.82 148.04 8.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.86 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.8 m -79.88 172.46 13.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.073 0.463 . . . . 0.0 111.671 -178.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.846 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -70.32 -29.34 66.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.355 -179.442 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.56 -36.57 78.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.983 0.42 . . . . 0.0 110.436 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.895 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.6 OUTLIER -74.11 -36.68 64.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.912 -0.586 . . . . 0.0 109.703 178.938 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.824 ' O ' HG23 ' A' ' 41' ' ' VAL . 2.5 tpt -67.74 -47.29 69.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.615 178.702 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.846 HG23 ' O ' ' A' ' 34' ' ' GLU . 92.3 t -56.27 -46.06 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.167 179.287 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -58.36 -47.15 84.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.137 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 36' ' ' ASP . 42.6 t -59.0 -40.92 81.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.759 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 37' ' ' MET . 20.3 t -67.32 -48.88 76.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.696 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.96 -46.27 78.63 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.529 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -64.39 -41.14 96.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.55 179.542 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.88 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 7.5 m0 -60.83 -42.88 98.6 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.777 179.706 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.418 ' HA ' HD13 ' A' ' 74' ' ' LEU . 4.6 ttp -68.17 -43.53 78.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.299 -178.44 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -72.42 -34.05 67.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.896 0.379 . . . . 0.0 110.054 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.517 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.03 -43.81 97.67 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.116 179.441 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -69.09 -45.72 69.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.334 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.691 HD11 ' HB3' ' A' ' 71' ' ' ARG . 2.0 mm -55.25 -55.7 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.364 -179.273 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.459 ' HA ' ' HD2' ' A' ' 53' ' ' ARG . 20.8 m-80 -65.5 -36.28 83.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.145 0.498 . . . . 0.0 110.731 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.527 ' CD1' ' HG3' ' A' ' 55' ' ' GLN . 0.7 OUTLIER -62.19 -45.61 92.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.517 -179.497 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.546 ' CD2' HD13 ' A' ' 70' ' ' LEU . 17.3 m-85 -76.01 -33.46 59.68 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -178.731 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 49' ' ' ILE . 0.8 OUTLIER -63.53 -24.99 68.05 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 119.849 -0.741 . . . . 0.0 110.755 -179.697 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -98.79 -16.01 19.07 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.404 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.527 ' HG3' ' CD1' ' A' ' 51' ' ' TYR . 7.0 mm-40 -102.09 45.85 0.95 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.609 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.563 ' HB ' ' CD ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -125.0 173.54 10.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.173 0.511 . . . . 0.0 111.496 179.353 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.435 ' O ' ' NE ' ' A' ' 63' ' ' ARG . 12.1 p -144.17 171.16 14.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.183 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.49 -155.52 30.97 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.2 -1.0 . . . . 0.0 112.891 179.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.46 ' O ' ' NE ' ' A' ' 63' ' ' ARG . 1.4 mt-10 -67.9 144.76 97.5 Favored Pre-proline 0 C--N 1.333 -0.15 0 CA-C-O 120.755 0.312 . . . . 0.0 111.221 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.473 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 42.3 Cg_endo -67.45 -25.64 41.46 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.784 2.323 . . . . 0.0 113.084 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.56 -43.89 95.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.13 0.49 . . . . 0.0 110.886 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.44 ' HB2' ' NH2' ' A' ' 63' ' ' ARG . 1.8 mt-10 -60.71 -43.36 97.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.045 179.344 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.704 ' O ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -55.26 -51.39 66.79 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.298 0.57 . . . . 0.0 109.605 179.219 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.33 -41.49 72.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.705 -178.734 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.427 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 0.2 OUTLIER -63.25 -49.78 72.76 Favored 'General case' 0 CA--C 1.523 -0.081 0 C-N-CA 119.941 -0.704 . . . . 0.0 110.328 179.888 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.94 -40.91 90.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.307 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.704 HD13 ' O ' ' A' ' 63' ' ' ARG . 2.4 mp -61.96 -45.89 91.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.459 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' A' ' 71' ' ' ARG . 2.2 pp0? -66.72 -38.23 86.27 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.189 0.519 . . . . 0.0 110.06 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.89 -30.89 71.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.545 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.546 HD13 ' CD2' ' A' ' 52' ' ' TYR . 1.9 mt -71.02 -49.84 40.62 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.141 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.691 ' HB3' HD11 ' A' ' 49' ' ' ILE . 6.7 ptt85 -56.4 -40.26 74.35 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.455 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 1.1 mt-30 -72.9 -35.91 67.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.227 0.537 . . . . 0.0 109.555 178.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -45.48 94.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.093 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 45' ' ' MET . 11.5 mt -67.87 -45.08 75.53 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.121 0.486 . . . . 0.0 110.329 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.7 -38.17 60.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.756 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.402 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 2.6 p -80.86 -50.7 9.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.137 0.494 . . . . 0.0 110.624 179.212 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.408 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 4.4 mt -56.59 -33.01 65.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.148 -179.196 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.19 -31.02 60.83 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.559 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.4 OUTLIER -51.85 -50.23 79.14 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.228 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.559 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 52.5 Cg_endo -69.73 -33.98 15.6 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.522 2.148 . . . . 0.0 113.177 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.821 ' HB2' HD22 ' A' ' 22' ' ' LEU . 2.2 t80 -66.15 -53.56 36.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.982 0.42 . . . . 0.0 110.505 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.8 mt -58.31 -29.02 65.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.796 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.9 -47.94 60.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.87 0.367 . . . . 0.0 110.475 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -41.42 84.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.527 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.54 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.3 OUTLIER -76.19 -33.41 59.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.759 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 mmt-85 -67.11 -40.5 86.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.045 0.45 . . . . 0.0 110.098 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.66 -36.89 68.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.926 179.057 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.455 ' HE2' HD21 ' A' ' 31' ' ' LEU . 26.4 t80 -72.46 -28.78 63.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.676 179.15 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.553 HD23 ' HG3' ' A' ' 34' ' ' GLU . 2.2 mp . . . . . 0 C--N 1.326 -0.423 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.808 0.337 . . . . 0.0 111.213 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 61.64 116.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.016 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.3 -17.47 62.57 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.991 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.67 -46.66 88.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.92 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -62.69 -56.0 21.7 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.047 0.451 . . . . 0.0 110.232 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 mtpt -58.42 -30.78 67.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.618 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.61 -44.45 82.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.196 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.2 tp -60.04 -45.1 93.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.783 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.538 HG22 HD23 ' A' ' 15' ' ' LEU . 43.6 mm -60.49 -54.23 38.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.878 179.14 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.8 m -51.92 -33.06 35.49 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.869 0.366 . . . . 0.0 110.697 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.76 -44.42 77.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.241 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.466 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.2 -28.22 72.97 Favored Glycine 0 N--CA 1.451 -0.365 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 177.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.538 HD23 HG22 ' A' ' 11' ' ' ILE . 1.7 mm? -70.08 -61.37 1.8 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.52 -0.84 . . . . 0.0 110.253 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.659 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.8 ttpm? -59.3 -36.07 74.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.985 0.421 . . . . 0.0 110.086 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -60.58 -49.39 77.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.275 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.505 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -71.26 -49.31 44.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.391 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.609 ' HA ' HD12 ' A' ' 22' ' ' LEU . 1.3 m -55.36 -51.55 66.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.966 0.413 . . . . 0.0 110.802 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.659 HG23 ' O ' ' A' ' 16' ' ' LYS . 46.3 t -66.45 -34.95 73.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.065 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.864 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 0.5 OUTLIER -65.88 -46.21 79.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.641 0.258 . . . . 0.0 111.199 -179.741 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.66 HD23 ' CD2' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -64.38 -40.91 96.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.951 0.405 . . . . 0.0 110.358 179.857 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -82.78 -17.25 44.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.149 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.451 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 0.9 OUTLIER -105.35 6.98 33.13 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.851 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -50.77 162.23 0.28 Allowed 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 177.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.7 p -108.24 133.87 51.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 119.322 0.965 . . . . 0.0 110.868 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.454 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.6 m-85 -107.28 95.72 5.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.312 0.577 . . . . 0.0 110.937 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -144.95 144.03 30.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.221 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.598 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 5.4 p-10 -88.2 142.62 31.85 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.557 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.598 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 28.5 Cg_endo -62.32 150.46 62.3 Favored 'Cis proline' 0 C--N 1.349 0.603 0 C-N-CA 123.73 -1.362 . . . . 0.0 112.343 -0.149 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.56 HD23 ' CE2' ' A' ' 88' ' ' PHE . 3.6 mp -103.14 148.39 25.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.009 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.864 HG22 ' HB3' ' A' ' 36' ' ' ASP . 1.9 p -78.0 146.31 8.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.598 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.1 m -79.76 172.45 13.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.19 0.519 . . . . 0.0 111.809 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.904 ' O ' HG23 ' A' ' 38' ' ' VAL . 3.1 tt0 -64.63 -44.4 90.62 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.841 -178.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -34.49 77.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.185 0.517 . . . . 0.0 110.514 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.873 ' O ' HG23 ' A' ' 40' ' ' VAL . 9.2 t70 -72.22 -38.18 69.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.021 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.889 ' O ' HG23 ' A' ' 41' ' ' VAL . 2.0 tpt -67.81 -43.05 80.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.671 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 34' ' ' GLU . 46.5 t -57.97 -47.27 87.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.479 179.236 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -59.59 -46.98 87.35 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.858 0.361 . . . . 0.0 110.092 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.873 HG23 ' O ' ' A' ' 36' ' ' ASP . 40.6 t -58.75 -45.06 91.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.515 179.333 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.889 HG23 ' O ' ' A' ' 37' ' ' MET . 40.1 t -61.9 -48.57 87.96 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.383 179.356 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -58.27 -46.42 86.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.312 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.6 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -57.99 -45.6 86.53 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.076 179.175 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.864 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 10.9 m0 -60.21 -39.54 86.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.217 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.746 ' HG3' HD12 ' A' ' 74' ' ' LEU . 27.4 ttm -71.2 -43.95 66.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.784 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -73.66 -36.45 65.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.984 0.421 . . . . 0.0 110.022 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.6 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.22 -44.59 94.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.053 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -69.77 -43.67 71.7 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.944 0.402 . . . . 0.0 110.459 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.478 ' O ' ' CG ' ' A' ' 53' ' ' ARG . 9.8 mm -54.66 -55.72 14.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.47 ' HA ' ' HG3' ' A' ' 53' ' ' ARG . 11.3 t30 -62.07 -36.63 82.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.337 0.589 . . . . 0.0 110.373 179.316 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.521 ' HB2' ' O ' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -57.75 -48.53 79.36 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.332 179.72 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.575 ' O ' HG22 ' A' ' 56' ' ' VAL . 23.1 m-85 -75.63 -30.36 59.47 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.48 ' HG2' ' HG ' ' A' ' 67' ' ' LEU . 0.1 OUTLIER -62.77 -28.06 69.72 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.146 179.278 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -97.11 -15.8 20.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.02 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.475 ' HG3' ' CD1' ' A' ' 51' ' ' TYR . 12.2 mm-40 -102.71 45.19 0.97 Allowed 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.678 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -120.83 163.73 18.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.028 0.442 . . . . 0.0 111.144 179.22 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.02 171.6 14.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.565 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 81.19 -156.06 37.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.264 -0.969 . . . . 0.0 113.06 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -68.69 156.96 89.82 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.851 0.358 . . . . 0.0 111.235 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.434 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 43.8 Cg_endo -67.85 -23.34 41.52 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.674 2.249 . . . . 0.0 112.9 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -65.05 -44.07 90.22 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.84 0.352 . . . . 0.0 111.461 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -64.54 -42.77 95.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.079 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.678 ' HA ' HG11 ' A' ' 56' ' ' VAL . 15.8 mtt180 -53.77 -52.34 60.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -57.04 -42.18 80.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.866 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.41 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 0.1 OUTLIER -62.6 -31.86 72.76 Favored 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.55 179.909 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.438 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -72.82 -40.8 65.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.493 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.594 HD13 ' O ' ' A' ' 63' ' ' ARG . 0.6 OUTLIER -70.5 -35.87 73.47 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.556 -179.59 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.423 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 15.5 pt20 -72.82 -47.62 44.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.995 0.426 . . . . 0.0 110.272 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.464 ' O ' ' HB2' ' A' ' 73' ' ' GLU . 12.3 mt-10 -61.96 -36.57 81.84 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.271 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 66' ' ' ALA . 0.2 OUTLIER -64.71 -48.41 74.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.722 0.296 . . . . 0.0 110.253 179.087 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.7 ttt-85 -54.55 -43.45 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -31.78 65.09 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.149 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 4.3 tp10 -62.46 -49.48 75.27 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.128 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.746 HD12 ' HG3' ' A' ' 45' ' ' MET . 14.0 mt -67.87 -44.7 76.45 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.053 0.454 . . . . 0.0 110.524 178.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.38 -39.65 61.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.694 -179.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.426 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 27.7 m -80.91 -50.67 9.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.737 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.418 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 1.1 mt -55.8 -33.99 64.9 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.152 -179.185 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.85 -30.93 61.51 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.3 0.481 . . . . 0.0 112.3 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.558 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 4.8 m-20 -51.72 -50.24 78.62 Favored Pre-proline 0 C--N 1.328 -0.326 0 N-CA-C 111.811 0.301 . . . . 0.0 111.811 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.558 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 51.3 Cg_endo -69.65 -36.24 11.47 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.444 2.096 . . . . 0.0 113.092 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.66 ' CD2' HD23 ' A' ' 22' ' ' LEU . 3.4 t80 -62.99 -53.79 48.38 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.044 0.449 . . . . 0.0 110.514 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 59.6 mt -54.96 -31.85 60.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.769 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.81 -44.78 72.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.394 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 80' ' ' PRO . 6.0 mttm -57.39 -43.33 83.55 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.077 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.492 ' OH ' HG12 ' A' ' 32' ' ' VAL . 1.2 t80 -74.14 -33.53 63.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.997 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -45.71 93.65 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.08 -33.0 71.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.623 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.56 ' CE2' HD23 ' A' ' 31' ' ' LEU . 30.5 t80 -67.42 -29.06 68.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.173 179.066 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.5 HD13 ' HA ' ' A' ' 89' ' ' LEU . 0.9 OUTLIER -77.52 -44.12 29.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.613 178.926 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? -61.08 -34.32 74.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.943 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 29.1 m -60.95 -12.9 12.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.904 -178.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -63.86 175.19 1.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.72 ' O ' HD23 ' A' ' 94' ' ' LEU . 2.7 tp10 -120.8 158.8 26.79 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.72 HD23 ' O ' ' A' ' 93' ' ' GLU . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.738 179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.862 0.363 . . . . 0.0 111.119 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.415 ' C ' HD12 ' A' ' 4' ' ' LEU . 4.5 pp -113.52 -18.57 11.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.412 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.4 ttpt -51.1 -39.38 56.02 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.962 0.411 . . . . 0.0 110.743 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.19 -44.18 75.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.763 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -65.09 -43.21 92.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.307 179.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.703 ' HA ' HD12 ' A' ' 11' ' ' ILE . 5.3 tttp -65.17 -36.92 85.75 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.086 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.88 -44.51 92.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.836 0.35 . . . . 0.0 110.268 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.731 HD11 ' HG3' ' A' ' 55' ' ' GLN . 4.3 tp -61.01 -45.79 93.36 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.144 0.497 . . . . 0.0 109.837 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.703 HD12 ' HA ' ' A' ' 8' ' ' LYS . 11.9 mt -60.39 -53.68 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.013 179.08 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.2 p -54.31 -33.05 57.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.64 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.89 -41.45 82.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.75 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.498 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -70.24 -42.48 66.24 Favored Glycine 0 C--O 1.227 -0.316 0 N-CA-C 109.113 -1.595 . . . . 0.0 109.113 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.493 HD23 HG22 ' A' ' 11' ' ' ILE . 1.7 mm? -54.41 -58.27 8.08 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 113.822 -1.189 . . . . 0.0 109.221 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.461 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -60.38 -29.43 68.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.503 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.461 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -68.82 -46.44 68.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.437 179.616 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.579 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -71.83 -46.43 58.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.821 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 79.0 p -55.43 -51.52 66.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.02 0.438 . . . . 0.0 110.366 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.426 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 77.5 t -67.16 -31.11 51.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.564 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.898 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 18.0 tp -64.27 -46.38 83.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.895 0.379 . . . . 0.0 110.237 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.784 HD22 ' HB2' ' A' ' 81' ' ' PHE . 9.4 mt -66.26 -36.61 83.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.256 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.61 -17.41 44.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.386 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.426 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 0.4 OUTLIER -111.81 6.46 19.67 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -179.066 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.522 HE22 HD23 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -48.56 162.59 0.09 Allowed 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 177.594 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 23.5 t -110.66 134.33 53.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 119.592 1.087 . . . . 0.0 110.23 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.42 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 13.4 m-85 -110.58 95.43 5.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.652 0.739 . . . . 0.0 110.916 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -124.01 151.72 43.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.361 -1.29 . . . . 0.0 111.2 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.531 ' HA ' ' N ' ' A' ' 31' ' ' LEU . 0.5 OUTLIER -100.87 145.87 31.13 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.778 179.664 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.98 115.05 3.2 Favored 'Cis proline' 0 C--N 1.35 0.623 0 C-N-CA 123.497 -1.46 . . . . 0.0 112.147 -0.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.538 HD11 ' NE2' ' A' ' 92' ' ' HIS . 1.4 mp -44.32 146.78 0.63 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.967 -179.14 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.437 HG12 ' OH ' ' A' ' 85' ' ' TYR . 9.9 p -77.69 155.98 5.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.729 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.416 ' N ' HG22 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -79.85 171.7 14.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.124 0.488 . . . . 0.0 111.725 -178.612 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.93 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -71.05 -31.68 68.19 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.648 -179.271 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -67.07 -37.01 83.25 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.238 0.542 . . . . 0.0 110.182 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.901 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.4 OUTLIER -72.65 -34.71 67.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.465 178.686 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.723 ' O ' HG23 ' A' ' 41' ' ' VAL . 2.6 tpt -67.78 -46.1 72.98 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.45 178.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.93 HG23 ' O ' ' A' ' 34' ' ' GLU . 59.8 t -55.83 -47.99 78.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.303 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.401 HG22 ' O ' ' A' ' 36' ' ' ASP . 0.5 OUTLIER -58.06 -46.72 84.95 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.896 0.379 . . . . 0.0 110.027 179.362 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.901 HG23 ' O ' ' A' ' 36' ' ' ASP . 46.8 t -57.22 -47.5 84.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.577 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.723 HG23 ' O ' ' A' ' 37' ' ' MET . 32.8 t -61.37 -47.97 91.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.554 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -56.36 -48.53 76.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.505 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.591 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 1.8 m-20 -60.04 -45.07 94.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.681 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.898 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 13.1 m0 -60.72 -42.48 97.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.087 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 39.8 mtm -66.63 -48.74 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -178.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -70.48 -32.84 70.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.977 0.418 . . . . 0.0 110.063 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.591 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -62.75 -42.6 99.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.043 179.338 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.472 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 6.3 m-85 -69.82 -44.81 69.22 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.335 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.458 HD12 ' HA ' ' A' ' 49' ' ' ILE . 0.3 OUTLIER -57.34 -55.29 21.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.937 0.399 . . . . 0.0 110.758 -179.874 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -66.4 -41.19 89.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.906 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.492 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 5.0 t80 -60.43 -46.0 91.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.367 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.569 ' O ' HG22 ' A' ' 56' ' ' VAL . 25.9 m-85 -70.19 -31.29 68.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.738 -0.664 . . . . 0.0 112.184 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.911 ' HB2' HD21 ' A' ' 67' ' ' LEU . 34.5 ttm-85 -59.12 -27.96 66.09 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.684 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -94.99 -17.93 21.51 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.731 ' HG3' HD11 ' A' ' 10' ' ' LEU . 5.5 pt20 -105.54 45.13 0.98 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -124.1 163.5 23.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.525 178.792 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.4 m -127.07 166.45 17.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.441 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 91.6 -149.79 19.99 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.715 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -80.63 157.02 72.73 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.804 0.335 . . . . 0.0 111.005 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.435 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 42.6 Cg_endo -67.72 -19.75 47.11 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.874 2.383 . . . . 0.0 113.479 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -66.2 -43.98 85.21 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.891 0.376 . . . . 0.0 111.446 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -66.7 -35.43 80.11 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.181 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.532 ' HG3' ' HB ' ' A' ' 56' ' ' VAL . 2.2 mpt_? -59.48 -50.96 71.91 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -58.44 -41.64 85.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.548 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -49.67 73.9 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.262 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.486 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.13 -33.76 67.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.269 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.911 HD21 ' HB2' ' A' ' 53' ' ' ARG . 4.2 mp -69.68 -34.28 73.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.279 179.073 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.539 ' HA ' ' HG2' ' A' ' 71' ' ' ARG . 0.8 OUTLIER -74.43 -48.75 25.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.559 179.506 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.443 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 7.2 mm-40 -63.28 -30.34 71.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.875 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.501 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 1.4 tp -73.65 -48.4 32.65 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.686 -0.406 . . . . 0.0 109.945 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.539 ' HG2' ' HA ' ' A' ' 68' ' ' GLN . 6.7 ptp180 -56.88 -38.48 72.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.441 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.514 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 3.1 pt20 -75.03 -36.0 61.9 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.287 0.565 . . . . 0.0 109.51 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.473 ' OE2' HD11 ' A' ' 15' ' ' LEU . 4.1 mm-40 -62.63 -42.17 99.43 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.397 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.574 HD23 ' CD2' ' A' ' 18' ' ' PHE . 37.6 mt -67.86 -45.21 75.22 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.126 0.489 . . . . 0.0 110.009 178.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -53.78 -38.65 64.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.137 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.7 -34.53 34.54 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.059 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.426 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 3.4 mt -74.5 -28.15 60.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.046 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.08 -29.82 60.77 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.569 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.1 m120 -54.69 -50.19 87.12 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.461 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 45.1 Cg_endo -68.74 -37.04 12.75 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.403 2.069 . . . . 0.0 112.81 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.784 ' HB2' HD22 ' A' ' 22' ' ' LEU . 1.5 t80 -63.94 -52.61 58.96 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.087 0.47 . . . . 0.0 110.254 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 60.0 mt -57.04 -28.13 62.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.721 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.97 -46.73 61.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.905 0.383 . . . . 0.0 110.369 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.9 mmmt -57.09 -43.09 81.86 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.296 179.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.518 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.3 OUTLIER -76.05 -33.32 59.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.62 179.551 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.403 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 40.8 mtt180 -64.87 -42.37 94.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.065 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.41 ' HA ' ' HG2' ' A' ' 90' ' ' LYS . 0.4 OUTLIER -72.59 -34.32 67.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.268 0.556 . . . . 0.0 109.73 178.784 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.499 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 6.9 t80 -71.04 -28.71 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.627 179.159 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.679 HD23 ' HG3' ' A' ' 34' ' ' GLU . 4.2 mp -78.31 -45.47 22.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.083 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.41 ' HG2' ' HA ' ' A' ' 87' ' ' ASP . 0.0 OUTLIER -74.08 -35.38 64.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.499 -179.266 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.402 ' N ' ' HG3' ' A' ' 90' ' ' LYS . 23.2 t -79.16 -8.58 59.12 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.538 ' NE2' HD11 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -79.39 111.97 16.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.965 0.412 . . . . 0.0 111.418 -179.746 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -121.73 122.78 40.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.49 177.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mp . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.338 -0.839 . . . . 0.0 110.895 -179.937 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.553 HD22 ' N ' ' A' ' 3' ' ' LEU . 2.9 mm? . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 120.852 0.358 . . . . 0.0 111.414 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.9 mp 54.05 -89.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.524 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.426 ' HA ' ' HG2' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -56.66 -30.0 62.89 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.03 0.443 . . . . 0.0 110.837 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.16 -44.83 87.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.184 179.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -62.59 -53.45 54.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.462 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.877 ' HA ' HD12 ' A' ' 11' ' ' ILE . 1.6 pttm -61.32 -31.86 71.72 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.736 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.94 -44.57 89.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.343 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.486 HD22 ' O ' ' A' ' 55' ' ' GLN . 1.7 tp -61.99 -43.79 98.1 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.877 HD12 ' HA ' ' A' ' 8' ' ' LYS . 7.6 mt -61.35 -54.36 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.504 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -55.45 -43.05 75.07 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.424 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.488 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -58.86 -43.36 90.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.851 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.687 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.83 -28.32 72.11 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 177.119 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.504 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.3 OUTLIER -65.41 -61.33 2.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.095 -1.053 . . . . 0.0 110.322 179.053 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.637 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.1 mtpt -58.0 -38.46 76.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.203 0.525 . . . . 0.0 109.932 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.6 tt0 -56.57 -49.57 74.46 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.279 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.665 ' CE2' HD23 ' A' ' 74' ' ' LEU . 0.7 OUTLIER -71.41 -50.58 30.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.553 -179.481 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -51.75 67.0 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.05 0.452 . . . . 0.0 110.776 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.637 HG23 ' O ' ' A' ' 16' ' ' LYS . 48.9 t -64.19 -35.64 74.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.625 179.566 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.928 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 0.3 OUTLIER -66.27 -45.87 79.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.688 0.28 . . . . 0.0 110.911 -179.855 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.738 HD22 ' CG ' ' A' ' 81' ' ' PHE . 11.1 mt -60.43 -40.26 90.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.885 0.374 . . . . 0.0 110.309 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.57 -21.93 35.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.938 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.479 ' HG3' ' HA ' ' A' ' 21' ' ' LEU . 0.4 OUTLIER -108.91 21.53 17.11 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.753 -179.432 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.664 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.1 OUTLIER -71.07 33.24 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -179.296 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.664 ' O ' ' O ' ' A' ' 25' ' ' GLN . 21.9 t 24.86 120.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 179.045 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -110.34 95.99 5.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.023 0.439 . . . . 0.0 110.573 178.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -149.13 139.9 22.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.35 -179.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.468 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 0.5 OUTLIER -62.69 148.5 91.09 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.695 179.752 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.468 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 46.4 Cg_endo -68.3 138.35 44.47 Favored 'Cis proline' 0 C--N 1.348 0.548 0 C-N-CA 123.589 -1.421 . . . . 0.0 112.408 0.057 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.491 HD11 ' CE1' ' A' ' 92' ' ' HIS . 4.2 mt -83.86 133.65 34.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.317 -179.647 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.583 HG22 ' HB3' ' A' ' 36' ' ' ASP . 15.0 p -79.94 150.25 5.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.386 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.3 m -79.65 172.92 13.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.153 0.501 . . . . 0.0 111.632 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.959 ' O ' HG23 ' A' ' 38' ' ' VAL . 1.2 tm-20 -67.52 -42.62 82.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.904 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -67.92 -37.79 82.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.19 0.519 . . . . 0.0 110.599 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.829 ' O ' HG23 ' A' ' 40' ' ' VAL . 9.0 t0 -67.96 -37.76 81.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.353 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.547 ' O ' HG23 ' A' ' 41' ' ' VAL . 6.4 tpt -68.43 -39.9 81.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.733 178.614 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.959 HG23 ' O ' ' A' ' 34' ' ' GLU . 92.6 t -56.77 -45.71 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.682 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -46.21 91.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.937 178.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.829 HG23 ' O ' ' A' ' 36' ' ' ASP . 37.0 t -55.46 -48.34 77.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.791 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 37' ' ' MET . 22.7 t -67.87 -41.35 84.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.925 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -43.68 79.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.105 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.584 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 2.8 p30 -71.54 -38.62 71.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.246 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.928 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 6.6 m0 -60.98 -41.34 96.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.019 0.438 . . . . 0.0 110.474 178.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.758 ' HG2' HD22 ' A' ' 74' ' ' LEU . 47.8 mtm -71.01 -40.81 71.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.783 -179.229 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -73.39 -35.21 65.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.028 0.442 . . . . 0.0 110.138 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.584 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -65.44 -42.0 92.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.207 179.603 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.442 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 4.5 m-85 -69.2 -44.39 72.24 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.738 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.577 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -54.39 -54.33 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.321 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.556 ' HA ' ' HG3' ' A' ' 53' ' ' ARG . 20.6 t30 -61.64 -36.75 81.7 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 121.367 0.603 . . . . 0.0 109.886 178.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.451 ' HB2' ' O ' ' A' ' 47' ' ' PHE . 1.1 t80 -59.04 -43.98 91.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.91 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.687 ' OH ' ' HA3' ' A' ' 14' ' ' GLY . 30.2 m-85 -75.36 -30.67 60.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.641 ' HA ' HD11 ' A' ' 67' ' ' LEU . 15.5 mtp85 -60.85 -31.26 70.71 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.63 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -93.36 -13.08 28.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.396 -178.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.486 ' O ' HD22 ' A' ' 10' ' ' LEU . 4.6 mm-40 -107.15 39.99 1.76 Allowed 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.48 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.767 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -118.06 153.69 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.298 178.555 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.44 171.54 9.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.365 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.97 -152.93 25.13 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.954 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.401 ' O ' ' HG3' ' A' ' 63' ' ' ARG . 7.7 mt-10 -73.66 161.34 79.24 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-O 120.727 0.299 . . . . 0.0 110.991 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.426 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 42.7 Cg_endo -67.76 -25.1 40.04 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.53 2.153 . . . . 0.0 112.671 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -43.87 81.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.858 0.361 . . . . 0.0 111.138 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -66.65 -44.38 82.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.408 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.767 ' HA ' HG11 ' A' ' 56' ' ' VAL . 11.4 mtt85 -53.65 -51.45 63.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.14 -41.73 84.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.969 -179.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.471 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 8.5 tttp -64.22 -31.12 72.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.946 0.403 . . . . 0.0 110.86 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.756 ' O ' HD23 ' A' ' 70' ' ' LEU . . . -73.85 -34.76 64.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.984 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.641 HD11 ' HA ' ' A' ' 53' ' ' ARG . 3.6 mp -71.71 -36.56 70.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.361 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 20.3 pt20 -71.81 -46.49 58.01 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.417 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.0 OUTLIER -62.78 -33.82 75.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.931 178.936 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.756 HD23 ' O ' ' A' ' 66' ' ' ALA . 1.5 mm? -64.3 -49.33 72.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.774 179.16 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.9 tpp85 -55.34 -47.43 75.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.653 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.15 -36.28 79.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.324 0.583 . . . . 0.0 109.658 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -60.96 -42.54 98.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.723 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.758 HD22 ' HG2' ' A' ' 45' ' ' MET . 6.3 mt -67.74 -45.1 75.96 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.215 0.531 . . . . 0.0 109.954 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -52.53 -38.92 60.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.944 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.407 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 3.0 m -80.78 -50.61 9.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.79 -37.76 66.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.057 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.36 -27.84 59.31 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.561 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.7 t-20 -51.62 -50.02 79.55 Favored Pre-proline 0 CA--C 1.533 0.289 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.561 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.6 Cg_endo -69.09 -32.61 20.98 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.304 2.002 . . . . 0.0 113.082 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.738 ' CG ' HD22 ' A' ' 22' ' ' LEU . 10.6 t80 -64.66 -53.72 42.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.913 0.387 . . . . 0.0 110.905 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.3 mt -54.89 -37.82 66.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.185 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.36 -45.65 83.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.803 0.335 . . . . 0.0 110.591 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -58.17 -40.74 82.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.775 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.492 ' HE2' HG13 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -73.82 -33.62 64.23 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.752 179.849 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -43.45 98.81 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -72.68 -31.42 65.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.055 178.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -72.46 -29.08 63.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.905 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 85' ' ' TYR . 3.0 mm? -78.44 -44.96 23.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.257 0.551 . . . . 0.0 110.067 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -75.38 -38.68 59.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.893 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.5 m -78.89 -12.62 60.04 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.491 ' CE1' HD11 ' A' ' 31' ' ' LEU . 4.1 t60 -59.62 107.63 0.62 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.994 0.426 . . . . 0.0 111.323 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -121.16 105.87 11.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.401 178.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.0 pp . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.947 -179.829 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.6 mp . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.862 0.363 . . . . 0.0 111.137 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.521 HD12 ' O ' ' A' ' 4' ' ' LEU . 4.1 pp -161.12 28.01 0.14 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.091 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.6 -36.79 51.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.979 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.17 -46.87 87.26 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.69 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -62.86 -52.98 61.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.23 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.6 mmtp -59.41 -28.35 66.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.636 179.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.69 -45.12 68.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.499 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.467 HD12 ' CD1' ' A' ' 52' ' ' TYR . 0.0 OUTLIER -61.2 -43.65 98.54 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.149 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.779 HD11 ' HB1' ' A' ' 66' ' ' ALA . 41.8 mm -64.0 -54.6 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.917 179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.449 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 35.9 m -57.91 -33.24 68.55 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.745 0.307 . . . . 0.0 110.947 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.45 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -66.12 -42.92 88.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.674 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.488 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -71.14 -38.42 63.44 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 177.28 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.6 mm? -54.68 -59.96 4.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.018 -1.091 . . . . 0.0 109.447 178.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.607 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.1 OUTLIER -59.43 -33.55 71.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.027 0.441 . . . . 0.0 110.041 179.41 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.0 tp10 -61.27 -49.16 78.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.637 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.599 ' CE2' HD23 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -72.32 -49.09 37.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.845 -179.723 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 87.9 p -55.31 -43.57 75.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.939 0.4 . . . . 0.0 110.381 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 16' ' ' LYS . 87.6 t -74.36 -27.36 21.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.436 179.351 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.908 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 21.6 tp -68.9 -46.17 69.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.892 0.377 . . . . 0.0 110.305 179.572 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.977 HD22 ' CD2' ' A' ' 81' ' ' PHE . 9.3 mt -71.94 -35.14 69.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.433 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -82.71 -23.69 33.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.565 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.451 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -109.8 10.62 24.58 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.415 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.4 162.41 0.15 Allowed 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.2 t -110.3 134.98 50.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 119.645 1.111 . . . . 0.0 110.671 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 5.9 m-85 -109.6 95.54 5.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.784 0.802 . . . . 0.0 110.937 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -133.22 153.52 51.47 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.308 -1.315 . . . . 0.0 111.065 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.549 ' HA ' ' N ' ' A' ' 31' ' ' LEU . 3.4 m-20 -96.98 150.1 36.45 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.089 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -77.33 110.56 1.76 Allowed 'Cis proline' 0 C--N 1.35 0.636 0 C-N-CA 123.544 -1.44 . . . . 0.0 112.299 0.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.549 ' N ' ' HA ' ' A' ' 29' ' ' ASP . 1.2 mp -43.23 145.24 0.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.127 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.464 HG22 ' HB2' ' A' ' 36' ' ' ASP . 13.7 p -77.14 153.63 5.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.816 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.85 173.06 12.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.113 0.482 . . . . 0.0 111.636 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.904 ' O ' HG23 ' A' ' 38' ' ' VAL . 2.6 mt-10 -67.75 -39.16 84.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.165 -178.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -68.09 -37.36 81.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.136 0.493 . . . . 0.0 110.701 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.861 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.1 m-20 -70.5 -37.61 74.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.753 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.691 ' O ' HG23 ' A' ' 41' ' ' VAL . 16.2 tpp -66.99 -42.4 85.12 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.561 178.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 34' ' ' GLU . 99.1 t -56.85 -47.94 82.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.197 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -47.52 83.62 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.176 179.162 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.861 HG23 ' O ' ' A' ' 36' ' ' ASP . 39.1 t -55.7 -43.6 74.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.752 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.691 HG23 ' O ' ' A' ' 37' ' ' MET . 45.6 t -64.96 -45.47 94.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.712 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.46 -49.07 77.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.479 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -58.1 -43.26 87.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.882 179.306 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.908 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 5.3 m0 -60.64 -41.37 94.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.076 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.718 ' HG3' HD13 ' A' ' 74' ' ' LEU . 22.9 ttm -62.48 -50.57 70.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.053 -179.016 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -69.21 -35.47 76.25 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.472 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.37 -39.37 83.09 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.627 179.158 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.449 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 10.7 m-85 -72.24 -45.74 58.93 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.311 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 10.2 mm -54.07 -55.18 15.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.374 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -70.06 -35.99 74.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.906 0.384 . . . . 0.0 111.169 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.442 ' CE1' ' HG3' ' A' ' 55' ' ' GLN . 2.2 t80 -63.07 -45.8 90.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.502 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.491 ' O ' ' CG2' ' A' ' 56' ' ' VAL . 36.0 m-85 -75.5 -33.1 60.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.857 ' HB2' HD21 ' A' ' 67' ' ' LEU . 12.3 ttp85 -58.56 -30.98 67.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.818 0.342 . . . . 0.0 110.578 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -95.35 -11.07 28.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.889 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.442 ' HG3' ' CE1' ' A' ' 51' ' ' TYR . 1.8 mt-30 -99.86 -5.67 28.07 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -178.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.874 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.8 OUTLIER -73.15 154.01 7.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.711 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 18.7 p -120.87 171.16 8.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.476 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.56 -147.64 23.25 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.69 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.21 164.83 54.42 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.341 . . . . 0.0 110.862 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.405 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 42.6 Cg_endo -67.62 -22.53 44.01 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.616 2.211 . . . . 0.0 112.76 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.407 ' HA ' ' OD2' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -67.29 -44.02 80.31 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.149 0.5 . . . . 0.0 110.778 -179.934 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.6 -41.53 99.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.008 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.874 ' HA ' HG11 ' A' ' 56' ' ' VAL . 12.0 mtt180 -56.9 -51.17 70.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.009 179.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.407 ' OD2' ' HA ' ' A' ' 61' ' ' GLN . 0.3 OUTLIER -57.05 -41.71 79.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.433 -179.118 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.48 -49.73 76.37 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.461 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.779 ' HB1' HD11 ' A' ' 11' ' ' ILE . . . -56.9 -33.37 66.85 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.055 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.857 HD21 ' HB2' ' A' ' 53' ' ' ARG . 5.4 mp -71.18 -33.27 69.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.607 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -72.17 -49.04 38.82 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -62.24 -30.72 71.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.195 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.465 HD11 ' CE2' ' A' ' 52' ' ' TYR . 0.4 OUTLIER -67.39 -49.14 65.13 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.068 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.37 -48.32 74.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.783 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -72.11 -31.73 66.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.99 0.424 . . . . 0.0 110.071 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.429 ' OE2' HD11 ' A' ' 15' ' ' LEU . 3.5 mm-40 -61.64 -48.3 81.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.865 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.718 HD13 ' HG3' ' A' ' 45' ' ' MET . 9.2 mt -67.7 -44.68 77.15 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.048 0.451 . . . . 0.0 110.617 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.3 m-20 -52.8 -42.06 64.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.462 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.4 t -80.65 -34.19 35.09 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.436 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.479 HD13 ' HD2' ' A' ' 18' ' ' PHE . 2.8 mt -73.5 -30.22 62.99 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.106 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.11 -29.89 60.7 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -179.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.562 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 11.7 m-20 -57.33 -50.2 89.53 Favored Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 111.558 0.207 . . . . 0.0 111.558 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.562 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 44.9 Cg_endo -69.8 -37.59 8.86 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.36 2.04 . . . . 0.0 112.649 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.977 ' CD2' HD22 ' A' ' 22' ' ' LEU . 1.5 t80 -64.76 -52.57 56.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.055 0.455 . . . . 0.0 110.678 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.415 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 28.5 mt -57.1 -30.02 64.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.576 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.81 -48.04 64.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.558 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.83 -41.78 78.45 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.949 0.404 . . . . 0.0 110.266 179.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.653 ' CD2' ' HE2' ' A' ' 37' ' ' MET . 0.2 OUTLIER -74.65 -33.2 62.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.294 179.391 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.415 ' HB3' ' O ' ' A' ' 82' ' ' LEU . 0.0 OUTLIER -63.37 -42.45 98.87 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.935 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.411 ' HA ' ' HG2' ' A' ' 90' ' ' LYS . 0.3 OUTLIER -72.64 -32.88 66.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.946 178.854 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.524 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 9.3 t80 -72.59 -28.78 63.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.049 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.518 HD23 ' O ' ' A' ' 85' ' ' TYR . 2.2 mm? -78.32 -45.28 23.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.018 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.411 ' HG2' ' HA ' ' A' ' 87' ' ' ASP . 0.1 OUTLIER -75.46 -36.72 60.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.621 -179.288 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 53.7 m -75.52 -11.04 59.94 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.418 ' NE2' HD11 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -76.71 113.96 14.94 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.843 0.354 . . . . 0.0 111.07 -179.868 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -51.34 101.36 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.336 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.8 pp . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.243 -0.884 . . . . 0.0 111.361 -179.946 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.649 HD22 ' C ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 120.903 0.383 . . . . 0.0 111.325 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.1 mp -85.01 103.62 14.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.778 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -43.16 85.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.945 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.54 -45.43 91.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.847 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -63.62 -46.68 84.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.225 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.638 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -63.56 -30.69 71.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.603 179.537 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -67.26 -45.35 76.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.437 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.833 HD21 ' HG3' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -62.72 -42.19 99.53 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.506 -0.554 . . . . 0.0 109.506 178.73 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.638 HD12 ' HA ' ' A' ' 8' ' ' LYS . 25.4 mt -62.35 -54.06 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.037 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.2 t -57.47 -33.24 67.76 Favored 'General case' 0 C--N 1.333 -0.144 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 -179.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.12 -42.63 75.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.782 0.325 . . . . 0.0 110.861 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.61 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.91 -40.06 74.58 Favored Glycine 0 C--O 1.225 -0.459 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 177.16 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.902 HD21 ' HG2' ' A' ' 73' ' ' GLU . 1.7 mm? -54.81 -59.17 5.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.592 -1.304 . . . . 0.0 109.448 178.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.413 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -60.23 -30.93 69.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.543 179.685 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 0.6 OUTLIER -67.69 -46.36 72.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.241 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.599 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -69.74 -49.36 53.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.718 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 74.6 p -55.4 -50.44 69.75 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.133 0.492 . . . . 0.0 110.151 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.452 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 47.2 t -62.56 -34.55 65.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.271 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.966 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 12.2 tp -62.56 -46.22 89.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.469 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.997 HD13 ' HB2' ' A' ' 81' ' ' PHE . 6.0 mt -63.91 -37.24 86.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.095 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.69 -17.44 44.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.824 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 13.6 mt-30 -106.99 -3.4 20.14 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.103 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -46.9 160.09 0.09 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 19.7 t -104.69 128.41 58.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 118.81 0.732 . . . . 0.0 111.73 -179.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -102.23 121.27 41.93 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.838 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.439 ' O ' ' HA ' ' A' ' 31' ' ' LEU . 3.3 p30 -149.33 145.74 27.18 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.495 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.406 ' HA ' ' N ' ' A' ' 31' ' ' LEU . 1.7 p30 -86.75 151.37 52.46 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.294 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -77.99 17.09 8.95 Favored 'Cis proline' 0 C--N 1.347 0.489 0 C-N-CA 123.536 -1.443 . . . . 0.0 113.281 0.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.906 HD13 ' CE1' ' A' ' 92' ' ' HIS . 0.7 OUTLIER 72.55 144.67 0.07 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.364 0.602 . . . . 0.0 111.94 179.213 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.447 HG21 ' HB3' ' A' ' 36' ' ' ASP . 11.4 p -77.1 157.54 5.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.04 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.445 ' N ' HG22 ' A' ' 32' ' ' VAL . 3.0 p -79.51 171.01 15.74 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.263 0.554 . . . . 0.0 111.909 -178.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.893 ' O ' HG23 ' A' ' 38' ' ' VAL . 1.5 mt-10 -68.76 -34.45 75.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.112 -178.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -34.73 78.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.9 0.381 . . . . 0.0 110.716 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.886 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.3 OUTLIER -71.8 -42.15 67.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.115 179.454 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.671 ' O ' HG23 ' A' ' 41' ' ' VAL . 12.5 tpp -65.15 -43.43 91.83 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 34' ' ' GLU . 93.9 t -55.89 -48.0 79.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.305 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -46.62 88.23 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.864 0.364 . . . . 0.0 110.364 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.886 HG23 ' O ' ' A' ' 36' ' ' ASP . 23.7 t -56.75 -45.47 82.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.835 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.671 HG23 ' O ' ' A' ' 37' ' ' MET . 39.5 t -66.73 -44.98 89.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.789 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -51.16 71.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.415 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.2 OUTLIER -60.05 -43.48 95.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.156 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.966 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 7.9 m0 -60.78 -41.06 94.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.337 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.9 ttp -68.0 -43.98 77.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.327 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -70.87 -39.81 72.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.941 0.401 . . . . 0.0 110.014 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.445 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -59.38 -41.5 89.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.574 179.091 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.453 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 3.9 m-85 -65.01 -48.09 75.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.775 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.858 HD11 ' HB2' ' A' ' 71' ' ' ARG . 0.7 OUTLIER -54.2 -55.0 16.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.082 -179.395 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.457 ' N ' HG22 ' A' ' 49' ' ' ILE . 70.9 m-80 -68.97 -36.74 78.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.806 0.336 . . . . 0.0 111.085 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.445 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 7.0 t80 -63.07 -42.04 99.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.126 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.645 ' O ' HG22 ' A' ' 56' ' ' VAL . 27.8 m-85 -75.47 -33.68 60.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.54 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.674 ' HA ' HD11 ' A' ' 67' ' ' LEU . 2.8 ttm-85 -58.37 -31.59 67.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.12 0.486 . . . . 0.0 110.581 179.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -101.03 -9.81 21.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.196 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.833 ' HG3' HD21 ' A' ' 10' ' ' LEU . 12.4 tp-100 -97.54 -3.29 40.04 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.662 ' HB ' ' CG ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -78.81 173.58 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.469 179.564 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.457 HG22 ' H ' ' A' ' 58' ' ' GLY . 5.0 m -139.79 171.09 14.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.034 179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.457 ' H ' HG22 ' A' ' 57' ' ' THR . . . 88.15 -150.4 22.07 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.171 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.411 ' O ' ' HD2' ' A' ' 63' ' ' ARG . 0.4 OUTLIER -77.9 162.95 65.67 Favored Pre-proline 0 C--N 1.334 -0.103 0 CA-C-O 120.829 0.347 . . . . 0.0 111.286 -179.693 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.431 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 40.2 Cg_endo -67.26 -26.62 41.71 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.914 2.409 . . . . 0.0 113.319 -179.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -70.82 -44.18 67.05 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.067 0.461 . . . . 0.0 110.891 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -67.38 -38.25 84.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.959 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.662 ' CG ' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -57.64 -51.3 70.07 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.39 0.614 . . . . 0.0 109.427 178.896 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -58.06 -41.64 83.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.649 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 9.5 tttt -61.59 -49.69 75.62 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.474 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.1 -33.66 67.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.22 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.674 HD11 ' HA ' ' A' ' 53' ' ' ARG . 5.5 mp -69.99 -36.55 75.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.32 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 1.9 pp0? -72.89 -44.74 60.92 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.218 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -63.03 -38.59 91.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.351 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.447 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -63.39 -49.11 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.792 179.521 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.858 ' HB2' HD11 ' A' ' 49' ' ' ILE . 2.7 tpt180 -55.19 -44.85 75.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.523 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.26 -34.52 76.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.24 0.543 . . . . 0.0 109.846 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.902 ' HG2' HD21 ' A' ' 15' ' ' LEU . 1.2 tp10 -60.88 -45.3 95.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.068 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.9 mt -67.61 -45.08 76.46 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.972 0.415 . . . . 0.0 110.366 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -39.8 63.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.011 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.464 HG22 ' O ' ' A' ' 73' ' ' GLU . 10.3 t -80.55 -36.15 33.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.041 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.448 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 2.4 mt -71.24 -29.88 65.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.898 -179.436 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.84 -30.08 63.73 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.566 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.5 t30 -57.73 -50.09 90.06 Favored Pre-proline 0 CA--C 1.532 0.28 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.566 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 40.5 Cg_endo -67.69 -42.01 7.44 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.278 1.985 . . . . 0.0 112.828 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.997 ' HB2' HD13 ' A' ' 22' ' ' LEU . 1.8 t80 -63.76 -52.59 59.72 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.155 0.502 . . . . 0.0 110.036 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.403 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 24.1 mt -56.59 -29.28 61.9 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.429 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.445 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.03 -48.33 63.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.847 0.356 . . . . 0.0 110.519 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.2 mmtm -57.17 -40.78 77.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.551 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.46 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -77.61 -33.15 53.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.721 -179.544 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.445 ' HG2' ' HA ' ' A' ' 83' ' ' ALA . 1.0 OUTLIER -68.33 -40.52 81.57 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.016 179.409 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.59 -37.21 68.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.862 179.078 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.513 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 9.1 t80 -71.92 -29.22 64.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.14 178.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.746 HD23 ' HG2' ' A' ' 34' ' ' GLU . 0.5 OUTLIER -78.64 -45.52 21.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.422 178.1 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -67.24 -32.3 73.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.8 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 75.1 m -77.64 -2.42 35.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.514 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.906 ' CE1' HD13 ' A' ' 31' ' ' LEU . 46.0 m170 -83.69 105.2 14.41 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.861 0.362 . . . . 0.0 110.945 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.67 103.04 0.06 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.051 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 25.5 mt . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.93 -179.99 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.598 ' O ' ' HB3' ' A' ' 6' ' ' ALA . 28.1 mt . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.668 0.27 . . . . 0.0 111.296 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.641 ' N ' HD13 ' A' ' 4' ' ' LEU . 0.1 OUTLIER -54.02 -48.55 70.37 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.827 0.346 . . . . 0.0 111.058 -179.962 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -22.37 32.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.688 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.598 ' HB3' ' O ' ' A' ' 3' ' ' LEU . . . -63.88 -44.2 93.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.52 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 25.1 m-20 -63.59 -57.64 9.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.977 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -57.57 -34.21 68.98 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.852 179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -62.32 -44.12 97.23 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.443 . . . . 0.0 109.831 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.44 ' HA ' HD22 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -60.63 -43.32 97.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.716 178.862 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.808 HD11 ' HB1' ' A' ' 66' ' ' ALA . 40.5 mm -62.04 -54.58 32.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.027 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.01 -32.91 22.77 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.668 0.271 . . . . 0.0 111.222 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.13 -42.06 69.7 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.596 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.554 ' N ' ' OH ' ' A' ' 52' ' ' TYR . . . -71.07 -28.42 70.39 Favored Glycine 0 C--O 1.231 -0.085 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 177.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.594 HD23 HG22 ' A' ' 11' ' ' ILE . 1.7 mm? -70.52 -61.17 1.87 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.511 -0.845 . . . . 0.0 109.092 178.364 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.619 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -57.21 -30.9 64.94 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.896 -179.954 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.419 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 1.5 mm-40 -68.24 -46.09 71.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.413 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.574 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -73.82 -47.38 39.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.351 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.52 -51.42 67.07 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.953 0.406 . . . . 0.0 110.484 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 16' ' ' LYS . 58.0 t -66.41 -36.77 78.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.642 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.992 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 0.8 OUTLIER -59.52 -46.18 89.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.76 0.314 . . . . 0.0 111.137 -179.818 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.918 HD13 ' HB2' ' A' ' 81' ' ' PHE . 15.0 mt -70.51 -34.92 72.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.987 0.422 . . . . 0.0 110.396 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -82.7 -18.43 40.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.154 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.489 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 10.2 mp0 -117.44 12.37 14.18 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -51.58 162.92 0.33 Allowed 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 177.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 24.2 t -112.57 136.41 48.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 119.854 1.206 . . . . 0.0 110.876 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.478 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.2 m-85 -112.15 95.26 5.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.776 0.798 . . . . 0.0 110.545 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -137.84 157.46 46.38 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.311 -1.313 . . . . 0.0 111.002 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.662 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 1.2 p30 -101.33 147.0 33.18 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.774 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.662 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 19.7 Cg_endo -58.08 142.61 23.76 Favored 'Cis proline' 0 C--N 1.351 0.704 0 C-N-CA 123.857 -1.31 . . . . 0.0 112.53 -0.048 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.461 HD22 ' CE2' ' A' ' 88' ' ' PHE . 7.6 mt -82.19 132.12 35.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.058 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.545 HG22 ' HB3' ' A' ' 36' ' ' ASP . 14.9 p -74.83 143.91 12.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.829 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.7 p -79.97 172.79 13.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.957 0.408 . . . . 0.0 111.537 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.899 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -71.07 -29.66 65.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.423 -179.515 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.44 -38.27 81.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.223 0.535 . . . . 0.0 110.267 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.888 ' O ' HG23 ' A' ' 40' ' ' VAL . 4.9 t70 -71.83 -36.92 70.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.501 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.743 ' O ' HG23 ' A' ' 41' ' ' VAL . 1.8 tpt -67.05 -45.71 76.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.482 178.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.899 HG23 ' O ' ' A' ' 34' ' ' GLU . 89.7 t -55.78 -46.54 79.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.302 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -46.3 88.94 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.847 0.356 . . . . 0.0 110.16 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.888 HG23 ' O ' ' A' ' 36' ' ' ASP . 35.0 t -58.41 -44.05 87.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.696 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.743 HG23 ' O ' ' A' ' 37' ' ' MET . 24.9 t -65.48 -48.47 82.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.611 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.58 -46.52 77.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.464 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.632 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -64.53 -40.89 96.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.542 179.56 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.992 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 5.8 m0 -60.83 -43.99 97.53 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.948 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.7 mtm -66.96 -48.91 67.1 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.781 -178.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -71.13 -28.1 64.04 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.632 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.76 -48.13 82.07 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.125 179.262 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -71.69 -38.48 70.59 Favored 'General case' 0 C--O 1.227 -0.09 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.114 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.687 HD11 ' HB2' ' A' ' 71' ' ' ARG . 10.8 mm -57.41 -55.34 21.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.799 0.333 . . . . 0.0 111.274 -179.249 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -67.33 -39.71 85.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.186 0.517 . . . . 0.0 110.386 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.499 ' HB3' ' O ' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -61.07 -38.2 85.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.485 179.599 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.554 ' OH ' ' N ' ' A' ' 14' ' ' GLY . 3.2 m-85 -76.1 -36.74 58.79 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -178.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.832 ' HA ' HD11 ' A' ' 67' ' ' LEU . 6.6 ttm180 -59.96 -26.53 66.07 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.419 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 54' ' ' GLN . 6.9 tt0 -93.79 -13.51 27.26 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.492 ' HG3' ' CE1' ' A' ' 51' ' ' TYR . 18.7 mm-40 -103.09 1.94 34.03 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -178.326 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.538 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -85.85 168.96 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.288 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.1 p -142.58 171.34 14.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.837 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 87.39 -153.54 25.31 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.373 -0.918 . . . . 0.0 112.774 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.5 144.34 86.31 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-O 120.683 0.277 . . . . 0.0 110.891 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.472 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 19.1 Cg_endo -59.12 -24.6 74.47 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.79 2.327 . . . . 0.0 112.725 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.07 -38.32 75.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.938 0.399 . . . . 0.0 110.673 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -68.65 -47.0 67.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.284 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.538 ' HA ' HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -63.51 -50.7 68.58 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.114 0.483 . . . . 0.0 110.066 179.743 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.39 -37.36 67.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.085 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.69 -50.14 59.19 Favored 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.467 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.808 ' HB1' HD11 ' A' ' 11' ' ' ILE . . . -59.57 -35.0 73.43 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.22 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.832 HD11 ' HA ' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -69.44 -40.49 77.17 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.116 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -72.08 -41.62 67.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.079 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.504 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 7.9 mt-10 -66.78 -37.67 85.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.721 HD23 ' HA ' ' A' ' 67' ' ' LEU . 0.4 OUTLIER -67.04 -44.48 80.11 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.282 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.687 ' HB2' HD11 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -55.21 -49.01 73.05 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.828 179.509 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.504 ' HG2' ' HA ' ' A' ' 69' ' ' GLU . 8.4 pt20 -63.31 -31.83 73.09 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.586 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.53 ' O ' HG22 ' A' ' 76' ' ' THR . 5.8 tp10 -63.83 -42.45 97.63 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.719 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.494 HD22 ' CD2' ' A' ' 18' ' ' PHE . 5.2 mt -68.02 -45.38 74.18 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 121.134 0.492 . . . . 0.0 110.062 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.76 -37.14 65.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.004 -179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 73' ' ' GLU . 11.0 t -80.86 -32.8 34.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.704 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.419 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 1.5 mt -75.07 -29.64 60.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.895 -179.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.17 -32.1 61.18 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.552 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 3.1 m120 -52.12 -50.2 80.22 Favored Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 49.0 Cg_endo -69.92 -34.98 13.0 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.353 2.036 . . . . 0.0 112.76 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.918 ' HB2' HD13 ' A' ' 22' ' ' LEU . 1.8 t80 -65.31 -53.67 40.49 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.1 mt -58.81 -28.08 65.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.449 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.483 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.71 -41.3 75.55 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.105 0.479 . . . . 0.0 110.376 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -42.52 92.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.587 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.545 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.4 OUTLIER -74.62 -37.92 62.7 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.927 -179.38 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.483 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 12.1 ptm180 -65.32 -37.31 86.73 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.5 -34.91 67.99 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.25 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.461 ' CE2' HD22 ' A' ' 31' ' ' LEU . 45.6 t80 -72.05 -28.29 63.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.765 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.707 HD13 ' CE1' ' A' ' 92' ' ' HIS . 1.1 mm? -75.05 -45.8 39.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.408 179.142 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -75.93 -34.49 59.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.624 -179.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 66.6 m -82.47 -17.0 46.76 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.707 ' CE1' HD13 ' A' ' 89' ' ' LEU . 0.7 OUTLIER -89.77 126.09 35.54 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.023 179.136 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -51.67 86.68 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.425 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.439 ' N ' ' O ' ' A' ' 92' ' ' HIS . 3.4 mt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.954 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.803 0.335 . . . . 0.0 111.087 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.5 mt -143.0 101.11 3.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.073 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -22.71 57.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.701 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -63.38 -46.77 84.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.958 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -63.27 -53.24 55.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.452 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.637 ' HA ' HD12 ' A' ' 11' ' ' ILE . 1.6 tttm -62.5 -30.9 71.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.988 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -67.78 -40.38 83.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.842 0.353 . . . . 0.0 110.347 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.637 HD11 ' NE2' ' A' ' 55' ' ' GLN . 3.5 tp -65.22 -44.28 88.82 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.637 HD12 ' HA ' ' A' ' 8' ' ' LYS . 16.8 mt -61.95 -54.5 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.523 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 23.1 t -55.61 -39.74 71.16 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.21 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.11 -40.11 80.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.23 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.506 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -70.66 -30.86 68.13 Favored Glycine 0 N--CA 1.451 -0.308 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.523 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.7 mm? -64.9 -61.33 2.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.102 -1.049 . . . . 0.0 110.608 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.623 ' O ' HG23 ' A' ' 20' ' ' VAL . 6.3 mttm -62.17 -36.59 82.33 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -59.72 -50.67 72.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.97 178.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.626 ' CE2' HD13 ' A' ' 74' ' ' LEU . 1.0 OUTLIER -67.26 -50.54 60.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.101 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 t -57.81 -51.63 68.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.874 0.369 . . . . 0.0 111.089 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 16' ' ' LYS . 58.9 t -64.75 -32.57 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.769 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.928 HD11 ' CH2' ' A' ' 44' ' ' TRP . 0.2 OUTLIER -70.36 -46.26 64.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.103 179.73 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.952 HD22 ' CD2' ' A' ' 81' ' ' PHE . 13.8 mt -62.1 -37.58 85.62 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.441 -179.359 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.63 -38.79 23.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.727 0.298 . . . . 0.0 111.603 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.732 ' O ' ' N ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -106.46 21.31 17.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.776 -179.208 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.488 ' N ' ' O ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -46.27 60.96 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.416 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.732 ' N ' ' O ' ' A' ' 24' ' ' GLN . 11.6 p 27.96 102.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 123.42 0.688 . . . . 0.0 112.517 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.52 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 14.2 m-30 -108.21 95.86 5.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.515 0.674 . . . . 0.0 111.185 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 66.4 m-20 -137.03 149.12 47.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.786 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.538 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 4.5 p-10 -95.95 136.79 21.97 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.426 179.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 32.4 Cg_endo -63.82 156.74 71.08 Favored 'Cis proline' 0 C--N 1.35 0.625 0 C-N-CA 123.825 -1.323 . . . . 0.0 112.415 0.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.489 HD11 ' CE2' ' A' ' 88' ' ' PHE . 7.1 mt -102.0 147.09 26.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.363 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.505 HG12 ' OH ' ' A' ' 85' ' ' TYR . 7.2 p -76.7 148.59 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.312 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.9 m -79.22 169.69 17.75 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.164 0.506 . . . . 0.0 111.535 -177.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.88 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.4 OUTLIER -67.53 -36.61 81.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.03 -179.142 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -36.53 84.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.152 0.501 . . . . 0.0 110.353 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.922 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.6 OUTLIER -74.2 -37.62 63.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.337 178.505 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.873 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.2 OUTLIER -64.35 -47.23 80.14 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.716 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 34' ' ' GLU . 60.2 t -57.61 -45.48 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.803 178.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.0 m -57.96 -47.9 81.55 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.822 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.922 HG23 ' O ' ' A' ' 36' ' ' ASP . 40.8 t -57.65 -40.24 74.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.808 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.873 HG23 ' O ' ' A' ' 37' ' ' MET . 5.1 t -63.02 -48.05 89.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.528 179.521 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.495 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 0.3 OUTLIER -54.77 -45.58 74.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.735 179.726 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.554 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -72.15 -36.38 69.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.746 179.648 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.928 ' CH2' HD11 ' A' ' 21' ' ' LEU . 1.9 m0 -64.46 -45.33 87.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.321 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.941 ' CB ' HD12 ' A' ' 74' ' ' LEU . 1.9 ptm -71.5 -36.14 71.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.495 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -71.94 -40.81 68.47 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.554 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.5 -46.19 91.04 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.793 179.099 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.474 ' CD1' ' CZ ' ' A' ' 52' ' ' TYR . 3.4 m-85 -60.3 -47.67 85.04 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.644 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.4 mm -54.19 -55.34 14.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.357 -179.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.52 ' HA ' ' HG2' ' A' ' 53' ' ' ARG . 43.9 t30 -69.8 -33.39 72.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.029 0.442 . . . . 0.0 111.171 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.481 ' CZ ' ' NE2' ' A' ' 55' ' ' GLN . 17.0 t80 -68.19 -40.95 82.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.782 -179.226 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.506 ' OH ' ' HA3' ' A' ' 14' ' ' GLY . 21.9 m-85 -75.68 -36.56 60.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.348 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.756 ' HB3' HD21 ' A' ' 67' ' ' LEU . 7.1 ptp85 -59.88 -24.64 64.43 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.498 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -92.52 -23.64 19.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.519 -179.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.637 ' NE2' HD11 ' A' ' 10' ' ' LEU . 29.0 mt-30 -93.71 34.21 1.22 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.036 0.446 . . . . 0.0 111.666 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.542 HG11 ' HG3' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -112.97 164.76 8.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.093 -179.665 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.6 m -138.45 171.74 13.92 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 81.56 -163.4 44.35 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 119.869 -1.158 . . . . 0.0 112.866 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -64.55 160.55 51.29 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-O 120.872 0.368 . . . . 0.0 111.36 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.427 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 43.7 Cg_endo -67.62 -26.96 39.17 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.92 2.413 . . . . 0.0 112.984 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.415 ' HA ' ' OD2' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -55.62 -41.4 73.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.183 0.516 . . . . 0.0 111.287 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -63.37 -46.66 85.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.029 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.542 ' HG3' HG11 ' A' ' 56' ' ' VAL . 2.3 mpt_? -56.09 -51.63 67.19 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.166 0.508 . . . . 0.0 110.26 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.415 ' OD2' ' HA ' ' A' ' 61' ' ' GLN . 0.1 OUTLIER -55.58 -41.6 73.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.256 -178.901 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -49.72 76.45 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.98 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.2 -36.93 71.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.946 -179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.756 HD21 ' HB3' ' A' ' 53' ' ' ARG . 7.8 mp -70.47 -33.26 71.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.8 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.409 ' CG ' ' O ' ' A' ' 64' ' ' ASP . 1.2 mt-30 -73.55 -48.54 32.17 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.941 0.401 . . . . 0.0 110.192 179.221 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.27 -33.19 74.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.423 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.538 ' O ' HD23 ' A' ' 74' ' ' LEU . 0.8 OUTLIER -69.39 -48.27 61.64 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.749 -0.38 . . . . 0.0 109.978 179.195 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -55.23 -40.83 71.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.926 0.393 . . . . 0.0 110.392 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.0 -46.41 43.85 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.408 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 34.2 mm-40 -60.61 -34.1 73.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.033 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.941 HD12 ' CB ' ' A' ' 45' ' ' MET . 0.1 OUTLIER -68.86 -47.02 66.99 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.284 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -53.72 -37.23 63.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.877 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.543 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 1.0 OUTLIER -81.14 -50.74 9.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.048 179.546 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.572 HD22 HD12 ' A' ' 22' ' ' LEU . 3.9 mt -60.18 -39.54 86.85 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 -178.403 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.24 -46.95 81.55 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -177.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.507 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.5 OUTLIER -50.98 -50.48 74.6 Favored Pre-proline 0 CA--C 1.535 0.393 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.264 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.543 ' CD ' ' O ' ' A' ' 76' ' ' THR . 50.5 Cg_endo -69.86 -24.09 29.59 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 122.313 2.009 . . . . 0.0 112.946 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.952 ' CD2' HD22 ' A' ' 22' ' ' LEU . 1.3 t80 -67.84 -53.48 26.55 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.769 0.319 . . . . 0.0 110.89 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.12 -29.31 60.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.523 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.12 -47.51 57.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.39 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.2 mmmm -56.98 -38.99 73.8 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.496 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.505 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.6 OUTLIER -73.85 -33.89 64.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.54 179.779 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -42.47 99.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.133 0.492 . . . . 0.0 109.757 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.88 -32.4 65.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.181 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.52 ' CE2' ' CD2' ' A' ' 27' ' ' PHE . 22.0 t80 -73.55 -28.72 62.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.956 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 85' ' ' TYR . 4.8 mt -76.59 -44.82 32.84 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.56 -34.41 75.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.957 -1.019 . . . . 0.0 111.45 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 77.5 p -101.37 0.58 37.28 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -178.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.492 ' HB2' ' O ' ' A' ' 88' ' ' PHE . 24.2 t60 -51.46 114.53 1.26 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.637 0.732 . . . . 0.0 111.919 -177.37 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -51.1 159.14 0.65 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 114.494 -1.23 . . . . 0.0 112.969 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.594 HD12 ' OXT' ' A' ' 94' ' ' LEU . 2.6 pp . . . . . 0 C--O 1.248 1.01 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.118 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 tp . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.714 0.292 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.516 HD12 ' HB2' ' A' ' 7' ' ' ASN . 0.5 OUTLIER -146.91 93.37 2.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.919 0.39 . . . . 0.0 111.264 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.413 ' O ' ' HB3' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -58.66 -20.72 50.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.923 179.393 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.62 -45.69 73.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.191 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.516 ' HB2' HD12 ' A' ' 4' ' ' LEU . 5.7 t-20 -62.4 -54.87 33.92 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.123 0.487 . . . . 0.0 110.356 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt -60.03 -29.3 68.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.048 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.413 ' HB3' ' O ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -70.26 -39.23 75.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.704 -0.226 . . . . 0.0 110.396 -179.946 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.506 HD22 ' O ' ' A' ' 55' ' ' GLN . 0.6 OUTLIER -65.67 -44.77 85.24 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 179.062 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.57 HD12 ' HB1' ' A' ' 66' ' ' ALA . 42.4 mm -62.06 -54.45 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.05 179.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.7 t -61.42 -34.29 75.13 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 120.815 0.34 . . . . 0.0 110.276 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.411 ' HB2' ' O ' ' A' ' 9' ' ' ASP . . . -59.11 -40.33 85.04 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.933 -179.352 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.481 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -68.96 -43.64 72.16 Favored Glycine 0 N--CA 1.454 -0.154 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 177.251 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.515 HD11 ' HG2' ' A' ' 73' ' ' GLU . 1.7 mm? -54.27 -58.62 6.69 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.081 -1.06 . . . . 0.0 109.613 178.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.554 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -60.84 -29.36 69.46 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.038 178.967 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.439 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 5.5 mt-10 -65.27 -48.9 71.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.977 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.506 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -65.49 -50.14 66.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.654 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -51.65 68.59 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.066 0.46 . . . . 0.0 110.787 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.554 HG23 ' O ' ' A' ' 16' ' ' LYS . 70.6 t -62.34 -28.26 44.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.477 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.98 HD11 ' CH2' ' A' ' 44' ' ' TRP . 1.5 tp -66.71 -46.45 75.51 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.818 HD13 ' HB2' ' A' ' 81' ' ' PHE . 2.1 mt -62.42 -38.1 88.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.776 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -24.88 34.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.31 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.454 ' C ' ' H ' ' A' ' 26' ' ' VAL . 3.1 tt0 -113.11 21.16 15.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.7 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.588 ' O ' ' O ' ' A' ' 26' ' ' VAL . 4.0 pp0? -70.25 34.59 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.295 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.588 ' O ' ' O ' ' A' ' 25' ' ' GLN . 16.5 t 31.93 115.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 178.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.578 ' CE2' ' NE2' ' A' ' 25' ' ' GLN . 2.7 m-85 -107.23 128.37 54.36 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.741 0.781 . . . . 0.0 110.682 178.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.783 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 9.2 p-10 -149.45 152.77 36.22 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.837 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -131.53 117.24 16.48 Favored Pre-proline 0 C--N 1.314 -0.966 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.998 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.72 172.96 56.57 Favored 'Cis proline' 0 C--N 1.348 0.542 0 C-N-CA 123.457 -1.476 . . . . 0.0 112.386 0.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.783 ' HB3' ' O ' ' A' ' 28' ' ' ASN . 2.7 pt? -157.71 -156.0 0.55 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.452 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.452 ' N ' ' HG ' ' A' ' 31' ' ' LEU . 13.7 p -74.49 138.92 20.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.411 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.8 p -80.31 175.37 10.71 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.016 0.436 . . . . 0.0 111.574 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.885 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -66.76 -38.89 87.51 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.117 -179.152 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.68 -36.07 82.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.287 0.565 . . . . 0.0 110.303 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.93 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -74.03 -34.81 64.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.427 178.77 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.791 ' O ' HG23 ' A' ' 41' ' ' VAL . 19.7 tpp -67.46 -47.31 70.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.629 178.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.885 HG23 ' O ' ' A' ' 34' ' ' GLU . 49.0 t -56.64 -47.66 81.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.423 179.369 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -58.07 -46.06 86.07 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.93 HG23 ' O ' ' A' ' 36' ' ' ASP . 48.2 t -59.13 -37.67 69.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.78 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 37' ' ' MET . 34.7 t -65.44 -49.13 80.17 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.781 0.324 . . . . 0.0 110.78 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.456 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 1.3 tt0 -55.37 -46.55 76.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.105 0.479 . . . . 0.0 110.777 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.625 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -71.74 -36.32 70.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.996 179.613 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.98 ' CH2' HD11 ' A' ' 21' ' ' LEU . 4.1 m0 -65.03 -45.82 83.87 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.523 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.828 ' CB ' HD12 ' A' ' 74' ' ' LEU . 1.6 ptm -71.41 -37.49 71.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.527 -179.399 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -71.34 -39.28 71.44 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.625 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.05 -45.88 92.97 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.058 179.194 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -61.64 -47.99 82.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.199 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.469 HG22 ' N ' ' A' ' 50' ' ' ASN . 0.6 OUTLIER -54.48 -55.28 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.217 -179.458 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.469 ' N ' HG22 ' A' ' 49' ' ' ILE . 30.0 t30 -69.46 -37.3 77.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.008 0.432 . . . . 0.0 111.09 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.461 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 21.2 t80 -61.26 -43.8 98.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.864 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.552 ' O ' HG22 ' A' ' 56' ' ' VAL . 23.5 m-85 -75.51 -29.29 59.46 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.244 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.795 ' CB ' HD21 ' A' ' 67' ' ' LEU . 10.4 ttm180 -57.55 -27.55 62.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.949 0.404 . . . . 0.0 110.172 178.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -101.81 -15.4 16.93 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.506 ' O ' HD22 ' A' ' 10' ' ' LEU . 26.5 mm-40 -97.53 46.21 1.03 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.821 0.343 . . . . 0.0 111.63 -179.247 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.833 HG21 ' HB3' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -125.3 164.62 24.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.299 -179.616 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 18.7 p -134.46 171.47 14.26 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 79.23 -149.95 33.03 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.016 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.98 156.12 92.46 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.822 0.344 . . . . 0.0 111.273 -179.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.517 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 42.8 Cg_endo -67.67 -25.94 39.79 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.73 2.287 . . . . 0.0 112.681 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.12 -41.68 93.16 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.894 0.378 . . . . 0.0 111.359 -179.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -61.1 -46.78 89.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.498 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.833 ' HB3' HG21 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.48 -50.81 68.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.207 0.527 . . . . 0.0 109.684 179.471 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -55.26 -41.4 72.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.693 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.462 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 14.5 ttmt -63.05 -49.91 72.7 Favored 'General case' 0 C--N 1.334 -0.104 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.656 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.57 ' HB1' HD12 ' A' ' 11' ' ' ILE . . . -57.23 -34.46 68.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.848 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.795 HD21 ' CB ' ' A' ' 53' ' ' ARG . 7.4 mp -71.81 -39.53 69.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.825 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 7.2 pt20 -73.2 -47.0 47.21 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.813 0.34 . . . . 0.0 110.403 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.49 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -62.32 -39.72 93.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.127 179.614 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.734 ' O ' HD23 ' A' ' 74' ' ' LEU . 7.0 mt -61.84 -48.89 78.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.197 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -55.45 -44.68 76.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.813 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.58 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -70.53 -38.26 74.21 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.142 0.496 . . . . 0.0 110.342 179.469 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.58 ' N ' ' HG3' ' A' ' 72' ' ' GLN . 1.7 tp10 -65.21 -32.78 74.62 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.24 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.828 HD12 ' CB ' ' A' ' 45' ' ' MET . 0.1 OUTLIER -68.44 -45.91 71.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.515 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -53.7 -39.71 65.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.988 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.481 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 7.3 t -80.74 -50.58 9.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.85 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.498 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.9 mt -58.07 -35.14 70.94 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -179.116 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.44 -38.37 71.33 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.114 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.534 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.9 m-80 -51.75 -50.28 78.51 Favored Pre-proline 0 C--N 1.328 -0.359 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.373 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 55.2 Cg_endo -70.08 -28.67 23.42 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.49 2.127 . . . . 0.0 113.18 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.818 ' HB2' HD13 ' A' ' 22' ' ' LEU . 2.3 t80 -65.51 -52.45 52.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.89 0.376 . . . . 0.0 111.4 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 55.0 mt -58.94 -28.64 66.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.841 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.25 -48.0 53.67 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.758 0.313 . . . . 0.0 110.434 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -56.93 -40.5 76.49 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.094 0.473 . . . . 0.0 110.115 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.5 ' CE2' ' HE2' ' A' ' 37' ' ' MET . 0.1 OUTLIER -70.95 -33.35 70.39 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.29 179.447 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 52.2 mmt-85 -61.52 -41.03 96.71 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.508 ' HA ' ' HG2' ' A' ' 90' ' ' LYS . 1.1 m-20 -72.71 -31.11 64.76 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.352 178.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.707 ' CZ ' ' CE1' ' A' ' 92' ' ' HIS . 43.9 t80 -75.96 -28.75 58.03 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.213 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.455 HD13 ' HA ' ' A' ' 89' ' ' LEU . 2.1 mm? -78.09 -45.28 23.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.564 179.177 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.508 ' HG2' ' HA ' ' A' ' 87' ' ' ASP . 15.2 ptpt -70.15 -34.12 72.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.08 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.441 ' HG ' ' HA ' ' A' ' 88' ' ' PHE . 87.3 p -78.96 -26.9 43.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.209 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.707 ' CE1' ' CZ ' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -63.29 110.67 1.97 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.895 0.379 . . . . 0.0 111.095 -179.781 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -52.64 91.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.231 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.8 mt . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.911 179.955 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.711 0.291 . . . . 0.0 111.147 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 mp -85.51 7.57 22.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.47 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.98 -27.62 14.0 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.323 0.582 . . . . 0.0 109.884 178.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.05 -44.42 74.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.786 178.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -61.94 -55.79 25.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.262 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.688 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -57.84 -31.72 66.93 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.038 -179.916 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.4 -43.78 84.85 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.566 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.25 -46.36 90.07 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.801 179.046 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.688 HD12 ' HA ' ' A' ' 8' ' ' LYS . 12.8 mt -60.66 -54.36 36.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.481 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -53.92 -38.6 65.04 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 120.921 0.391 . . . . 0.0 110.435 179.57 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -58.49 -43.65 89.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.979 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.494 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -66.81 -28.05 73.6 Favored Glycine 0 N--CA 1.452 -0.239 0 N-CA-C 110.076 -1.21 . . . . 0.0 110.076 176.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.1 OUTLIER -68.58 -61.48 1.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.475 -0.862 . . . . 0.0 110.617 179.397 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.602 ' O ' HG23 ' A' ' 20' ' ' VAL . 2.6 mmtp -56.78 -35.38 68.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.143 0.497 . . . . 0.0 110.11 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.1 tt0 -59.87 -50.72 72.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.663 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE2' HD23 ' A' ' 74' ' ' LEU . 0.2 OUTLIER -73.59 -44.74 56.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.472 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.402 ' HA ' HD12 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -60.11 -51.67 68.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.89 0.376 . . . . 0.0 110.774 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 16' ' ' LYS . 47.6 t -66.91 -33.49 63.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.676 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 1.012 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 1.1 tp -68.44 -45.69 71.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.862 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.645 ' CD1' HD22 ' A' ' 77' ' ' LEU . 2.8 mt -63.15 -42.85 99.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.83 0.347 . . . . 0.0 110.814 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -82.8 -23.78 33.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.82 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.478 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -117.58 21.53 12.94 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -178.727 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.584 HE22 ' HE1' ' A' ' 27' ' ' PHE . 1.1 pp0? -67.05 42.23 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.321 0.105 . . . . 0.0 111.247 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.478 ' H ' ' C ' ' A' ' 24' ' ' GLN . 16.8 t -6.79 124.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.112 0.965 . . . . 0.0 113.558 -179.691 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.584 ' HE1' HE22 ' A' ' 25' ' ' GLN . 17.9 m-85 -79.19 96.5 5.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.722 179.072 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.44 ' O ' ' O ' ' A' ' 30' ' ' PRO . 12.7 p-10 -85.22 136.83 33.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.196 -178.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.607 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 2.1 p-10 -99.71 135.15 20.62 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.223 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.607 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 19.3 Cg_endo -58.43 152.09 38.16 Favored 'Cis proline' 0 C--N 1.353 0.776 0 C-N-CA 124.153 -1.186 . . . . 0.0 112.621 0.088 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.601 HD22 ' HE2' ' A' ' 88' ' ' PHE . 4.0 mt -86.75 140.66 29.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.416 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.441 HG22 ' HB2' ' A' ' 36' ' ' ASP . 12.8 p -88.31 153.4 3.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.178 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.9 p -79.67 175.53 10.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.102 0.477 . . . . 0.0 111.806 -178.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.926 ' O ' HG23 ' A' ' 38' ' ' VAL . 14.5 pt-20 -70.3 -41.14 73.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.852 -178.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.34 -36.55 84.49 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.19 0.519 . . . . 0.0 110.496 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.847 ' O ' HG23 ' A' ' 40' ' ' VAL . 2.4 m-20 -73.49 -35.82 65.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.612 178.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.897 ' O ' HG23 ' A' ' 41' ' ' VAL . 2.7 tpt -66.87 -43.12 84.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.503 178.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.926 HG23 ' O ' ' A' ' 34' ' ' GLU . 50.5 t -59.48 -45.68 93.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.264 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -47.14 84.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.114 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.847 HG23 ' O ' ' A' ' 36' ' ' ASP . 22.9 t -58.6 -43.45 87.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.563 179.327 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 37' ' ' MET . 26.1 t -59.2 -48.83 85.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.589 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.55 -42.03 77.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.582 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -58.18 -46.44 85.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.149 179.368 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 1.012 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 28.8 m0 -60.69 -40.63 92.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.969 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.754 ' HG3' HD13 ' A' ' 74' ' ' LEU . 31.5 ttm -64.2 -50.89 66.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.769 -0.65 . . . . 0.0 112.379 -178.291 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -70.24 -29.31 66.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.002 0.43 . . . . 0.0 110.18 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.472 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.81 -42.33 97.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.122 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.428 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 27.0 m-85 -73.06 -41.74 63.83 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.527 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.9 mm -55.7 -55.4 17.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.499 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -69.48 -38.37 77.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.965 0.412 . . . . 0.0 110.968 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.413 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.7 t80 -59.89 -46.2 90.09 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.212 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.522 ' CE2' HD11 ' A' ' 70' ' ' LEU . 23.0 m-85 -75.84 -28.93 58.42 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.811 ' HB2' HD21 ' A' ' 67' ' ' LEU . 11.4 ttm180 -65.22 -28.66 69.52 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.746 -0.381 . . . . 0.0 110.757 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -91.49 -21.78 20.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.092 -178.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -94.17 46.1 1.15 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.657 HG11 ' HG3' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -132.19 -176.13 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.237 0.541 . . . . 0.0 112.0 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.985 ' O ' ' N ' ' A' ' 59' ' ' GLU . 1.5 p -128.49 163.67 24.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.399 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.403 ' O ' ' HD2' ' A' ' 60' ' ' PRO . . . -32.81 50.4 0.0 OUTLIER Glycine 0 N--CA 1.473 1.134 0 N-CA-C 115.003 0.761 . . . . 0.0 115.003 -178.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.985 ' N ' ' O ' ' A' ' 57' ' ' THR . 2.2 mm-40 -110.57 65.11 0.44 Allowed Pre-proline 0 N--CA 1.432 -1.346 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 176.09 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.403 ' HD2' ' O ' ' A' ' 58' ' ' GLY . 6.4 Cg_endo -51.42 -43.37 50.15 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 121.173 1.248 . . . . 0.0 111.015 -178.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -71.02 -36.3 72.36 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.621 178.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 59' ' ' GLU . 0.1 OUTLIER -79.63 -35.05 40.03 Favored 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 119.781 -0.768 . . . . 0.0 111.996 -179.68 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.657 ' HG3' HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -65.84 -52.5 49.92 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 179.758 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.29 -41.55 84.65 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.976 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.44 -45.79 71.58 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 119.946 -0.702 . . . . 0.0 110.077 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.95 -39.72 75.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.116 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.811 HD21 ' HB2' ' A' ' 53' ' ' ARG . 7.2 mp -69.82 -35.33 74.7 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.024 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.451 ' O ' ' HG2' ' A' ' 71' ' ' ARG . 3.9 mm-40 -70.42 -46.97 62.89 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.192 0.52 . . . . 0.0 109.728 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.1 -27.24 67.91 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.178 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.522 HD11 ' CE2' ' A' ' 52' ' ' TYR . 0.5 OUTLIER -73.36 -50.17 23.38 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.433 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 13.9 ptm180 -57.63 -41.56 81.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.304 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -31.36 61.09 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -61.59 -46.77 88.43 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.256 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.754 HD13 ' HG3' ' A' ' 45' ' ' MET . 1.2 mt -67.92 -42.83 80.47 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-O 121.051 0.453 . . . . 0.0 110.182 178.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -52.47 -42.08 63.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.177 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.1 t -81.13 -29.69 34.71 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.815 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.645 HD22 ' CD1' ' A' ' 22' ' ' LEU . 5.9 mt -79.37 -37.86 36.34 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.784 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.71 -29.89 59.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.626 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.567 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -51.07 -50.3 76.06 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.885 -178.975 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.567 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 45.7 Cg_endo -69.4 -31.02 22.98 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.061 1.841 . . . . 0.0 112.39 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.537 ' CD2' HD23 ' A' ' 22' ' ' LEU . 1.1 t80 -69.85 -54.59 12.84 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.602 HD21 HG21 ' A' ' 41' ' ' VAL . 73.7 mt -55.77 -34.45 65.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.146 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.643 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . . . -62.43 -48.28 80.37 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.299 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -44.7 88.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.966 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -71.32 -41.01 70.4 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.643 ' HG2' ' HA ' ' A' ' 83' ' ' ALA . 0.4 OUTLIER -62.75 -36.73 83.97 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.175 -179.71 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.441 ' N ' ' HG3' ' A' ' 86' ' ' ARG . 0.5 OUTLIER -72.82 -36.4 67.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.197 0.522 . . . . 0.0 109.93 178.645 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.601 ' HE2' HD22 ' A' ' 31' ' ' LEU . 18.5 t80 -70.5 -32.86 70.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.687 179.425 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -78.5 -45.2 22.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.42 0.629 . . . . 0.0 109.622 178.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -31.52 69.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.864 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 85.0 p -96.0 -18.01 20.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.573 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.476 ' CE1' ' CZ ' ' A' ' 88' ' ' PHE . 1.6 t60 -56.0 104.86 0.15 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.936 0.398 . . . . 0.0 111.513 -179.277 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -63.27 83.49 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.78 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.9 pp . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.855 -179.897 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.457 HD13 ' HA ' ' A' ' 3' ' ' LEU . 2.2 mm? . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.918 0.39 . . . . 0.0 111.233 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 mp -143.47 143.02 31.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.048 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -19.83 55.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.727 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.6 -45.54 85.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.12 -55.65 20.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.301 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.469 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -58.74 -28.18 65.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.894 179.816 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -71.17 -41.13 70.75 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.572 HD21 ' HG3' ' A' ' 55' ' ' GLN . 6.4 tp -62.13 -46.06 90.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.975 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.496 ' CG2' ' N ' ' A' ' 12' ' ' SER . 0.4 OUTLIER -62.99 -53.86 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 C-N-CA 120.506 -0.478 . . . . 0.0 109.743 179.174 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.496 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -55.83 -33.06 64.13 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 120.91 0.386 . . . . 0.0 110.433 179.503 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.01 -41.6 90.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.583 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.498 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.56 -42.44 72.53 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 177.147 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.477 HD21 ' OE1' ' A' ' 73' ' ' GLU . 3.9 mt -54.52 -59.52 4.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 113.844 -1.178 . . . . 0.0 109.32 178.761 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.542 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -59.59 -29.42 67.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.739 179.687 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.411 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 7.3 tt0 -68.47 -45.84 71.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.191 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.782 ' CD2' HD23 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -74.3 -48.45 28.31 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.065 -179.825 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 77.7 p -55.69 -49.75 72.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.031 0.444 . . . . 0.0 110.353 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 16' ' ' LYS . 91.3 t -68.24 -33.12 58.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.521 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.581 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 4.5 tp -63.77 -45.9 87.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.798 0.333 . . . . 0.0 110.725 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.664 ' CD1' HD22 ' A' ' 77' ' ' LEU . 4.8 mt -68.5 -36.63 79.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.952 0.406 . . . . 0.0 110.196 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -82.53 -17.54 44.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.505 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.446 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 31.1 mt-30 -111.11 14.25 21.86 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.401 ' HG3' ' CZ ' ' A' ' 81' ' ' PHE . 0.6 OUTLIER -49.47 162.73 0.14 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.734 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.52 131.73 58.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 119.491 1.041 . . . . 0.0 111.372 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -105.7 124.72 50.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.939 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.544 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 3.1 m120 -149.53 147.2 27.9 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.739 -179.269 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.563 ' HA ' HD23 ' A' ' 31' ' ' LEU . 0.7 OUTLIER -116.74 117.32 37.81 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.284 179.057 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.44 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 29.2 Cg_endo -62.75 165.67 39.96 Favored 'Cis proline' 0 C--N 1.351 0.686 0 C-N-CA 123.879 -1.3 . . . . 0.0 112.784 0.343 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.563 HD23 ' HA ' ' A' ' 29' ' ' ASP . 0.1 OUTLIER -126.64 167.05 16.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.024 179.797 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.2 p -70.41 143.67 14.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.195 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.96 172.14 14.17 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.278 0.561 . . . . 0.0 112.121 -178.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.887 ' O ' HG23 ' A' ' 38' ' ' VAL . 29.3 mt-10 -62.34 -43.78 98.02 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.328 -178.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -34.83 78.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.127 0.489 . . . . 0.0 110.929 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.899 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.2 m-20 -73.99 -36.95 64.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.656 178.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.627 ' O ' HG23 ' A' ' 41' ' ' VAL . 3.5 tpt -66.81 -47.95 70.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.639 178.66 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 34' ' ' GLU . 44.3 t -55.73 -45.79 79.44 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.236 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -58.12 -46.03 86.27 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.899 HG23 ' O ' ' A' ' 36' ' ' ASP . 46.0 t -57.75 -41.53 79.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.996 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 37' ' ' MET . 21.6 t -70.43 -46.96 68.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.23 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.05 -47.5 80.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.031 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.606 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 3.3 p30 -68.96 -35.05 76.31 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.061 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.581 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 3.9 m0 -60.72 -43.63 97.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.85 178.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.8 mtm -68.5 -45.71 71.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.661 -178.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.46 ' ND2' ' HA ' ' A' ' 43' ' ' ASP . 0.4 OUTLIER -71.58 -32.0 67.57 Favored 'General case' 0 CA--C 1.521 -0.154 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.914 179.707 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.606 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.96 -47.01 86.75 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.697 179.072 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.492 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 12.3 m-85 -65.88 -42.68 90.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.934 0.397 . . . . 0.0 110.582 179.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.407 ' HA ' HD13 ' A' ' 49' ' ' ILE . 12.4 mm -55.63 -55.44 17.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.364 -179.585 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -72.33 -38.64 68.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.123 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.471 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 13.4 t80 -60.71 -46.38 90.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.998 -179.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.623 ' O ' HG22 ' A' ' 56' ' ' VAL . 30.2 m-85 -75.6 -29.75 59.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.938 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.551 ' CB ' HD21 ' A' ' 67' ' ' LEU . 33.2 ttm180 -61.85 -27.95 69.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.826 0.346 . . . . 0.0 110.575 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -97.08 -16.01 20.71 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -178.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.572 ' HG3' HD21 ' A' ' 10' ' ' LEU . 6.0 pt20 -107.01 43.21 1.19 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.202 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.735 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -117.15 156.94 18.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.631 0.253 . . . . 0.0 110.364 178.538 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.4 p -131.08 171.46 13.22 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 85.24 -156.78 31.16 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.776 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -68.6 159.96 79.08 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.742 0.306 . . . . 0.0 111.034 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.412 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 43.3 Cg_endo -67.4 -27.97 39.56 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.641 2.227 . . . . 0.0 112.333 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -42.25 99.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.848 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.45 -46.59 85.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.559 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.735 ' HA ' HG11 ' A' ' 56' ' ' VAL . 7.9 mtt180 -53.74 -51.84 62.06 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.8 -42.15 75.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.563 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.427 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 2.2 tttt -63.75 -31.94 73.28 Favored 'General case' 0 CA--C 1.522 -0.111 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.732 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.69 -40.74 65.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.551 HD21 ' CB ' ' A' ' 53' ' ' ARG . 6.8 mp -71.71 -33.46 68.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.597 -179.558 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 18.6 pt20 -74.05 -48.97 26.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.868 0.366 . . . . 0.0 110.155 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.411 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 13.6 tt0 -63.11 -33.19 74.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.476 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.7 mt -67.69 -49.33 63.29 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 67.9 ttp85 -55.41 -45.75 76.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.607 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -71.98 -32.78 67.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.202 0.525 . . . . 0.0 109.851 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.477 ' OE1' HD21 ' A' ' 15' ' ' LEU . 15.8 mm-40 -63.49 -46.92 83.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.068 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.782 HD23 ' CD2' ' A' ' 18' ' ' PHE . 0.9 OUTLIER -67.9 -45.25 74.96 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 121.085 0.469 . . . . 0.0 110.396 178.699 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.09 -39.39 63.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.915 -179.337 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.1 p -80.69 -33.74 35.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.982 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.664 HD22 ' CD1' ' A' ' 22' ' ' LEU . 4.9 mt -73.14 -31.21 64.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.968 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.34 -30.26 61.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -179.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.56 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.6 m-80 -56.4 -50.34 88.24 Favored Pre-proline 0 C--N 1.328 -0.327 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -179.464 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.56 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 54.1 Cg_endo -69.67 -38.96 7.26 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.415 2.077 . . . . 0.0 112.667 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.519 ' CB ' HD22 ' A' ' 22' ' ' LEU . 6.1 t80 -62.91 -53.47 53.55 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.011 0.434 . . . . 0.0 110.5 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.1 mt -56.02 -30.57 62.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.749 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.522 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.0 -43.24 75.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.957 0.408 . . . . 0.0 110.528 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.3 mtmt -62.2 -43.3 99.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.818 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.441 ' O ' HD23 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -77.28 -33.55 55.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.875 -179.388 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.522 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 8.4 ptm180 -67.1 -38.5 85.76 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.183 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.75 -36.26 67.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.657 178.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.476 ' CZ ' ' CE1' ' A' ' 92' ' ' HIS . 15.0 t80 -71.55 -29.09 64.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.392 178.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.441 HD23 ' O ' ' A' ' 85' ' ' TYR . 0.7 OUTLIER -78.77 -45.3 21.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.653 178.451 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -71.23 -34.81 71.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.552 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.1 t -84.89 -5.6 59.34 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.476 ' CE1' ' CZ ' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -86.98 113.34 22.66 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.837 0.351 . . . . 0.0 111.253 -179.732 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -121.62 132.6 54.76 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.3 mt . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.001 -179.981 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.445 ' O ' ' HG ' ' A' ' 4' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 120.524 0.202 . . . . 0.0 111.17 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.729 HD12 ' O ' ' A' ' 4' ' ' LEU . 2.7 pp 34.21 36.78 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.015 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.72 -29.21 64.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.024 0.44 . . . . 0.0 110.951 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.07 -47.28 83.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.022 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -62.26 -54.6 38.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.02 0.438 . . . . 0.0 110.27 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.43 -31.21 65.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.512 179.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -65.89 -45.04 83.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.146 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.726 HD11 ' NE2' ' A' ' 55' ' ' GLN . 2.6 tp -59.9 -45.1 93.6 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 179.252 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.742 HG22 HD13 ' A' ' 15' ' ' LEU . 37.3 mm -60.05 -54.22 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.2 p -51.09 -32.98 24.13 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.817 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.03 -44.9 71.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.407 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.481 ' HA2' ' OE2' ' A' ' 17' ' ' GLU . . . -66.55 -28.14 73.57 Favored Glycine 0 N--CA 1.452 -0.296 0 N-CA-C 110.694 -0.962 . . . . 0.0 110.694 177.72 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.742 HD13 HG22 ' A' ' 11' ' ' ILE . 2.6 mp -75.45 -60.68 2.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.388 -0.906 . . . . 0.0 110.964 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.791 ' O ' HG23 ' A' ' 20' ' ' VAL . 12.7 ttpp -60.39 -36.81 78.95 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.712 0.291 . . . . 0.0 110.84 -179.467 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.481 ' OE2' ' HA2' ' A' ' 14' ' ' GLY . 8.1 pt-20 -67.37 -47.73 69.52 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.486 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.449 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 1.3 t80 -65.98 -44.39 85.01 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.205 179.114 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 71.2 m -56.84 -51.59 68.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.591 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 16' ' ' LYS . 58.7 t -63.42 -29.36 47.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.412 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.969 HD11 ' CH2' ' A' ' 44' ' ' TRP . 19.1 tp -70.26 -45.88 65.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.471 179.652 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.777 HD22 ' CD2' ' A' ' 81' ' ' PHE . 6.3 mt -65.95 -40.92 91.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.168 -179.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -82.52 -39.13 22.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.614 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.02 21.15 16.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.706 -179.379 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.659 ' O ' HG23 ' A' ' 26' ' ' VAL . 0.0 OUTLIER -36.06 -53.66 0.78 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.144 -179.855 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.659 HG23 ' O ' ' A' ' 25' ' ' GLN . 47.2 t 121.48 111.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.149 0.979 . . . . 0.0 110.405 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 8.2 m-30 -102.46 125.77 49.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.54 179.086 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.527 ' O ' ' HA ' ' A' ' 31' ' ' LEU . 1.4 m-80 -149.4 143.53 25.8 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.364 -179.45 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.455 ' HA ' ' N ' ' A' ' 31' ' ' LEU . 5.1 t70 -106.72 135.16 19.57 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.471 179.099 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -71.98 120.85 5.96 Favored 'Cis proline' 0 C--N 1.352 0.711 0 C-N-CA 123.834 -1.319 . . . . 0.0 112.382 0.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.596 HD13 ' CE1' ' A' ' 92' ' ' HIS . 0.8 OUTLIER -60.33 160.67 8.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.256 -178.973 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.628 HG12 ' OH ' ' A' ' 85' ' ' TYR . 14.1 p -80.45 157.82 4.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.984 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.458 ' N ' HG22 ' A' ' 32' ' ' VAL . 5.9 m -79.18 171.36 15.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.243 0.544 . . . . 0.0 111.687 -178.441 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.873 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -69.28 -37.5 77.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.943 -178.685 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.65 -32.96 74.6 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.955 0.407 . . . . 0.0 111.031 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.895 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -74.33 -39.51 62.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.985 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.907 ' O ' HG23 ' A' ' 41' ' ' VAL . 4.4 tpp -67.53 -45.17 76.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.881 179.069 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.873 HG23 ' O ' ' A' ' 34' ' ' GLU . 56.3 t -59.23 -44.35 91.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.611 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -61.05 -46.68 89.72 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.378 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 36' ' ' ASP . 43.2 t -58.8 -43.77 88.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.874 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.907 HG23 ' O ' ' A' ' 37' ' ' MET . 13.8 t -65.29 -46.25 91.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.848 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.69 -45.22 85.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.565 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.445 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -66.46 -42.31 87.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.49 179.495 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.969 ' CH2' HD11 ' A' ' 21' ' ' LEU . 9.5 m0 -60.87 -38.97 87.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.895 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 42.5 mtm -71.06 -42.24 69.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.246 -178.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -72.01 -40.52 68.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.852 0.358 . . . . 0.0 110.302 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.452 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -63.65 -39.37 94.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.019 179.382 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.43 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 1.6 m-85 -66.47 -48.46 69.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.063 -179.614 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.496 HG22 ' N ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -57.42 -55.75 19.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.758 -179.532 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.496 ' N ' HG22 ' A' ' 49' ' ' ILE . 33.9 t30 -63.14 -38.68 92.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.932 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.452 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 4.3 t80 -62.85 -45.93 90.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.621 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.504 ' CE2' HD11 ' A' ' 70' ' ' LEU . 32.7 m-85 -70.51 -30.39 67.14 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -178.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.589 ' HA ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -61.23 -19.39 61.6 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.019 179.633 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -102.42 -16.69 16.11 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.142 0.794 . . . . 0.0 113.142 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.726 ' NE2' HD11 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -100.18 46.16 0.96 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 120.617 -0.433 . . . . 0.0 112.081 -179.307 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.968 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -120.08 159.72 21.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.961 0.41 . . . . 0.0 111.106 179.396 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.6 p -134.71 171.74 13.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 82.56 -161.71 40.88 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.273 -0.965 . . . . 0.0 112.95 179.44 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.77 162.72 26.32 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-O 120.816 0.341 . . . . 0.0 111.007 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.56 -32.02 32.16 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.567 2.178 . . . . 0.0 112.557 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.54 -42.53 96.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.008 0.432 . . . . 0.0 111.047 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -62.35 -46.76 87.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.528 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.968 ' HA ' HG11 ' A' ' 56' ' ' VAL . 5.5 mtt180 -53.56 -52.13 60.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.286 0.565 . . . . 0.0 109.492 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -55.42 -42.23 73.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.45 -178.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.442 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 1.0 OUTLIER -61.76 -34.65 76.23 Favored 'General case' 0 CA--C 1.521 -0.137 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.506 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.506 ' HB1' HD11 ' A' ' 11' ' ' ILE . . . -71.29 -43.59 66.83 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.086 179.112 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.589 HD11 ' HA ' ' A' ' 53' ' ' ARG . 1.1 mp -66.08 -38.69 88.9 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.709 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 0.6 OUTLIER -70.01 -44.66 68.85 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.231 179.843 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 0.5 OUTLIER -62.3 -34.28 76.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.405 179.467 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.504 HD11 ' CE2' ' A' ' 52' ' ' TYR . 0.5 OUTLIER -65.1 -49.65 69.16 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.14 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.407 ' HB2' HD11 ' A' ' 49' ' ' ILE . 4.3 ttm-85 -55.28 -48.7 73.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.861 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.434 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.1 OUTLIER -68.68 -31.21 70.16 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.187 0.518 . . . . 0.0 110.092 179.196 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 0.0 OUTLIER -62.17 -45.7 92.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.948 179.761 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.61 -44.39 78.18 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.147 0.499 . . . . 0.0 110.29 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -52.25 -43.43 64.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.142 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.47 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 66.6 m -79.95 -50.48 10.36 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.708 0.289 . . . . 0.0 111.246 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 4.4 mt -56.69 -37.94 71.57 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.43 -37.05 77.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -178.174 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.529 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.1 t30 -51.65 -50.54 76.66 Favored Pre-proline 0 CA--C 1.534 0.335 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.545 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 53.2 Cg_endo -69.94 -34.68 13.51 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.583 2.189 . . . . 0.0 113.338 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.777 ' CD2' HD22 ' A' ' 22' ' ' LEU . 1.4 t80 -64.41 -53.79 42.99 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.698 0.285 . . . . 0.0 110.76 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.1 mt -53.94 -29.93 44.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.65 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.09 -44.7 65.16 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.257 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.0 -43.05 81.35 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.586 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.628 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -73.44 -33.33 64.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.942 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -46.09 83.81 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.93 -32.23 70.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.932 178.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.511 ' CE2' ' CD2' ' A' ' 27' ' ' PHE . 5.6 t80 -72.1 -28.76 63.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.448 179.112 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.537 HD23 ' O ' ' A' ' 85' ' ' TYR . 0.3 OUTLIER -78.07 -44.92 24.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.022 179.32 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.78 -38.75 62.08 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.503 -179.415 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 54.2 m -64.97 -16.24 63.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.997 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.596 ' CE1' HD13 ' A' ' 31' ' ' LEU . 26.8 m170 -76.59 105.38 7.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.913 0.387 . . . . 0.0 111.233 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -54.86 99.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.999 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.49 HD23 ' HB3' ' A' ' 92' ' ' HIS . 3.3 pp . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.913 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.88 0.371 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.546 HD22 ' OE1' ' A' ' 62' ' ' GLU . 18.5 mt -109.66 -27.12 9.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.01 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -24.57 23.67 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.937 0.399 . . . . 0.0 110.672 179.616 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.09 -43.95 74.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.557 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -65.07 -48.25 74.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.431 179.596 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.564 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -63.65 -28.25 69.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.954 179.926 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -72.76 -44.35 61.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.863 0.363 . . . . 0.0 110.213 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.782 HD11 ' HG3' ' A' ' 55' ' ' GLN . 5.1 tp -59.86 -49.29 78.29 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.361 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.794 HD11 ' HG3' ' A' ' 73' ' ' GLU . 0.1 OUTLIER -57.25 -49.73 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.042 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -55.24 -33.02 62.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.757 179.324 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.413 ' O ' ' HG2' ' A' ' 16' ' ' LYS . . . -67.92 -44.13 77.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.378 -179.527 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.485 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.59 -40.18 77.89 Favored Glycine 0 C--O 1.229 -0.175 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 177.19 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.654 HD23 HD11 ' A' ' 77' ' ' LEU . 3.3 mt -54.48 -59.21 4.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 113.761 -1.22 . . . . 0.0 109.557 178.671 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.811 ' O ' HG23 ' A' ' 20' ' ' VAL . 11.0 pttm -59.57 -31.02 69.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.418 179.444 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.2 -46.9 75.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.129 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.584 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -64.11 -49.17 73.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.095 -179.817 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 98.0 p -55.17 -51.41 66.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.875 0.369 . . . . 0.0 111.065 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 16' ' ' LYS . 38.1 t -61.42 -40.58 86.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.155 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.66 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 0.4 OUTLIER -64.47 -46.11 84.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.081 -179.589 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.974 HD22 ' CG ' ' A' ' 81' ' ' PHE . 33.0 mt -62.99 -36.54 83.86 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.301 -179.289 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -82.65 -22.42 34.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.602 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.467 ' C ' ' H ' ' A' ' 26' ' ' VAL . 1.7 mt-30 -117.4 21.86 12.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.668 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.522 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -66.01 37.08 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -179.162 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.522 ' O ' ' O ' ' A' ' 25' ' ' GLN . 18.4 t 31.6 112.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 178.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 88' ' ' PHE . 34.0 m-85 -107.25 96.09 6.17 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.357 0.599 . . . . 0.0 110.627 178.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.406 ' O ' ' O ' ' A' ' 30' ' ' PRO . 0.5 OUTLIER -122.98 152.75 40.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.613 -179.213 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.671 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 4.2 p-10 -106.18 139.81 20.65 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.99 179.133 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.671 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 13.3 Cg_endo -55.85 163.57 14.48 Favored 'Cis proline' 0 C--N 1.355 0.888 0 C-N-CA 124.315 -1.119 . . . . 0.0 112.513 0.103 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.517 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.9 mp -109.44 150.86 27.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.664 -179.281 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.65 HG12 ' OH ' ' A' ' 85' ' ' TYR . 13.8 p -76.45 148.9 6.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.33 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.4 m -79.77 172.41 13.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.144 0.497 . . . . 0.0 111.503 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.937 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -67.56 -38.95 84.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.732 -179.131 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -66.74 -37.31 84.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.164 0.507 . . . . 0.0 110.344 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.791 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.1 m-20 -68.55 -39.32 81.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.612 178.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.544 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -66.2 -41.66 89.89 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.478 178.742 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.937 HG23 ' O ' ' A' ' 34' ' ' GLU . 96.7 t -55.85 -47.94 78.98 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.915 179.069 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -46.92 85.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.988 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 36' ' ' ASP . 39.1 t -55.63 -52.03 52.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.76 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 37' ' ' MET . 38.9 t -61.03 -42.91 94.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.446 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.41 -50.24 74.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.451 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.487 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -59.18 -46.3 88.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.439 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.66 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 16.0 m0 -60.7 -40.45 92.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.583 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.431 ' HG3' HD13 ' A' ' 74' ' ' LEU . 3.2 ttp -67.74 -42.9 81.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.8 -179.288 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -73.51 -34.75 65.41 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.487 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.89 -45.22 90.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.763 179.157 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -65.45 -46.5 79.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.273 -179.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.818 HD11 ' HB2' ' A' ' 71' ' ' ARG . 0.6 OUTLIER -58.53 -55.5 22.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.66 -179.772 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.489 ' N ' HG22 ' A' ' 49' ' ' ILE . 18.1 t30 -62.47 -42.21 99.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.781 179.448 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.505 ' CD1' ' OE1' ' A' ' 55' ' ' GLN . 13.8 t80 -60.13 -48.89 79.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.771 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.633 ' CE2' HD21 ' A' ' 70' ' ' LEU . 5.3 m-85 -64.5 -33.66 76.41 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -179.374 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.621 ' HA ' HD11 ' A' ' 67' ' ' LEU . 5.8 mtm105 -56.37 -26.35 52.62 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.375 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -99.26 -16.15 18.61 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.782 ' HG3' HD11 ' A' ' 10' ' ' LEU . 1.9 pt20 -103.4 38.9 1.68 Allowed 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.612 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.671 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -110.56 159.13 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 178.465 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.437 HG22 ' H ' ' A' ' 58' ' ' GLY . 2.0 m -129.58 171.5 12.53 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.437 ' H ' HG22 ' A' ' 57' ' ' THR . . . 87.36 -155.9 27.61 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.893 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.2 160.33 83.01 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.706 0.289 . . . . 0.0 110.829 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.577 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 27.2 Cg_endo -62.23 -32.64 82.41 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.68 2.253 . . . . 0.0 112.718 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -62.47 -43.11 99.61 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.213 0.53 . . . . 0.0 110.871 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.546 ' OE1' HD22 ' A' ' 4' ' ' LEU . 19.3 mm-40 -60.68 -40.9 93.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.016 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.895 ' O ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -58.08 -50.95 71.69 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.686 179.271 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.37 -41.67 72.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.391 -179.039 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 5.7 tttm -66.52 -49.86 65.12 Favored 'General case' 0 CA--C 1.522 -0.112 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.278 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.42 -37.29 72.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.69 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.895 HD13 ' O ' ' A' ' 63' ' ' ARG . 8.1 mp -66.67 -41.81 87.57 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.093 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.414 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 1.7 pp0? -67.82 -41.7 82.67 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.85 0.357 . . . . 0.0 110.318 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.401 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 0.5 OUTLIER -62.25 -38.61 89.92 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.248 179.691 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.633 HD21 ' CE2' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -61.4 -48.7 80.03 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.011 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.818 ' HB2' HD11 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -55.27 -48.97 73.25 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.088 -179.66 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.6 -32.67 72.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.075 0.464 . . . . 0.0 110.223 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.794 ' HG3' HD11 ' A' ' 11' ' ' ILE . 25.1 mm-40 -60.59 -45.59 93.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.953 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.431 HD13 ' HG3' ' A' ' 45' ' ' MET . 10.1 mt -67.76 -44.44 77.49 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.022 0.439 . . . . 0.0 110.521 178.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -52.64 -42.78 64.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.227 -179.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.1 m -78.29 -32.74 49.59 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.023 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.654 HD11 HD23 ' A' ' 15' ' ' LEU . 2.7 mt -72.72 -30.67 64.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.844 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.79 -28.87 60.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.571 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.7 t30 -58.49 -50.17 89.5 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.822 0.304 . . . . 0.0 111.822 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.571 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 46.7 Cg_endo -69.03 -41.01 5.65 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.462 2.108 . . . . 0.0 113.014 -179.605 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.974 ' CG ' HD22 ' A' ' 22' ' ' LEU . 5.1 t80 -58.21 -50.18 74.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.033 0.444 . . . . 0.0 110.869 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.1 mt -54.53 -37.24 65.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.327 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.24 -44.27 79.86 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.771 0.319 . . . . 0.0 110.615 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.83 -40.88 76.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.067 0.46 . . . . 0.0 110.34 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.65 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.4 OUTLIER -76.15 -33.36 59.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.632 179.499 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.43 ' HG2' ' N ' ' A' ' 87' ' ' ASP . 0.0 OUTLIER -61.12 -45.92 92.73 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.054 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.43 ' N ' ' HG2' ' A' ' 86' ' ' ARG . 0.4 OUTLIER -71.05 -33.57 70.4 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.071 178.939 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.517 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 16.8 t80 -69.59 -28.81 66.28 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.263 178.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.621 HD23 ' HG3' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -72.44 -44.58 62.2 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 178.23 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.81 -31.07 71.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.907 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 m -60.53 -10.72 5.44 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -176.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -52.45 159.37 1.03 Allowed 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 178.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.519 ' O ' HD12 ' A' ' 94' ' ' LEU . 2.0 mt-10 -123.53 81.98 1.96 Allowed 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 119.154 0.888 . . . . 0.0 111.787 178.336 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 93' ' ' GLU . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.834 -179.303 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.619 HD12 ' N ' ' A' ' 7' ' ' ASN . 1.7 pt? . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.726 0.298 . . . . 0.0 111.146 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.715 HD12 ' N ' ' A' ' 5' ' ' LYS . 2.6 pp -132.23 -50.46 0.94 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.057 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.715 ' N ' HD12 ' A' ' 4' ' ' LEU . 2.5 ttpt -77.46 -42.38 36.16 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.733 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.74 -45.14 95.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.382 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.619 ' N ' HD12 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -60.93 -50.28 74.05 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.713 179.62 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.505 ' HG2' ' HA ' ' A' ' 5' ' ' LYS . 0.3 OUTLIER -61.94 -28.3 69.44 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.12 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.404 ' N ' ' HG3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -74.79 -46.17 38.71 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.495 -179.79 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.793 HD11 ' HG3' ' A' ' 55' ' ' GLN . 0.5 OUTLIER -59.57 -49.06 79.22 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.787 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.487 ' CG2' ' N ' ' A' ' 12' ' ' SER . 1.2 tt -56.77 -51.64 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.22 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.487 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 3.5 m -51.12 -33.44 26.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.361 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.54 -47.3 55.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.867 0.365 . . . . 0.0 111.085 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -66.93 -27.99 73.62 Favored Glycine 0 C--O 1.229 -0.162 0 N-CA-C 110.169 -1.173 . . . . 0.0 110.169 177.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.722 HD13 HD11 ' A' ' 77' ' ' LEU . 2.3 mm? -71.32 -61.25 1.84 Allowed 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.328 -0.936 . . . . 0.0 110.159 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.779 ' O ' HG23 ' A' ' 20' ' ' VAL . 9.1 tttt -57.74 -36.78 72.54 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.37 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -63.95 -49.61 71.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.677 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.537 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -67.52 -42.53 82.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.956 -179.476 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.1 m -55.48 -50.13 70.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.001 0.429 . . . . 0.0 110.942 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.779 HG23 ' O ' ' A' ' 16' ' ' LYS . 24.7 t -66.47 -39.33 83.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.637 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.902 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 2.8 tp -64.27 -46.13 85.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.743 0.306 . . . . 0.0 111.462 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.607 HD23 ' CD2' ' A' ' 81' ' ' PHE . 0.7 OUTLIER -65.87 -42.35 90.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.05 -179.403 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -82.6 -17.96 42.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.911 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.43 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 13.3 tt0 -117.66 21.61 12.86 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -179.127 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.631 ' O ' HG23 ' A' ' 26' ' ' VAL . 0.6 OUTLIER -49.6 -67.35 0.27 Allowed 'General case' 0 C--N 1.331 -0.23 0 O-C-N 122.388 -0.195 . . . . 0.0 111.151 179.757 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' ' 25' ' ' GLN . 50.2 t 120.57 119.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.161 0.984 . . . . 0.0 110.667 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -105.36 101.15 10.7 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.977 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -125.33 142.08 51.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.892 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.04 154.01 93.4 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.823 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -83.37 25.41 9.16 Favored 'Cis proline' 0 C--N 1.346 0.429 0 C-N-CA 123.345 -1.523 . . . . 0.0 112.949 0.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.432 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.0 OUTLIER 68.79 136.39 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.985 0.421 . . . . 0.0 111.205 179.893 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.552 HG12 ' OH ' ' A' ' 85' ' ' TYR . 5.5 p -80.72 157.25 4.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.634 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.67 171.19 15.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.134 0.492 . . . . 0.0 111.5 -178.54 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.881 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -71.02 -32.0 68.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.28 -179.302 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.08 -35.98 82.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.013 0.435 . . . . 0.0 110.196 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.884 ' O ' HG23 ' A' ' 40' ' ' VAL . 6.2 t70 -70.7 -42.37 70.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.855 179.003 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.857 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -63.1 -44.79 94.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.815 179.13 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.881 HG23 ' O ' ' A' ' 34' ' ' GLU . 58.3 t -57.11 -47.27 84.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.699 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.402 ' CG2' ' N ' ' A' ' 40' ' ' VAL . 0.5 OUTLIER -63.52 -47.36 81.97 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.48 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 36' ' ' ASP . 41.7 t -59.33 -42.94 88.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.725 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.857 HG23 ' O ' ' A' ' 37' ' ' MET . 54.8 t -66.3 -48.6 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.476 179.513 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.08 -44.67 83.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.349 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.492 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -59.07 -48.42 81.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.435 179.506 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.902 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 32.5 m0 -60.84 -41.12 95.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.462 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.454 ' HG3' HD13 ' A' ' 74' ' ' LEU . 22.5 ttm -67.77 -43.0 80.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.64 -179.245 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -73.22 -33.26 65.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.987 0.422 . . . . 0.0 109.906 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.492 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -62.54 -41.89 99.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.856 179.151 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -70.65 -43.02 70.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.707 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.865 HD11 ' HB3' ' A' ' 71' ' ' ARG . 2.2 mm -56.23 -55.1 20.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.966 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.0 m-80 -68.36 -40.14 81.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.01 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.414 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.5 t80 -59.06 -53.66 55.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.722 ' CD1' HD13 ' A' ' 10' ' ' LEU . 23.5 m-85 -68.8 -28.52 66.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.405 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.754 ' HA ' HD21 ' A' ' 67' ' ' LEU . 42.2 ttm-85 -59.72 -28.96 67.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.07 0.462 . . . . 0.0 110.16 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.3 -9.42 19.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.792 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.793 ' HG3' HD11 ' A' ' 10' ' ' LEU . 11.6 tp60 -95.64 11.96 31.44 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -178.768 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.88 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -94.89 177.05 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.236 0.541 . . . . 0.0 111.615 -179.813 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 35.0 p -149.53 171.74 16.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.299 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 80.33 -173.98 54.93 Favored Glycine 0 CA--C 1.519 0.296 0 C-N-CA 120.241 -0.98 . . . . 0.0 114.015 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.426 ' O ' ' HD2' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -52.7 152.26 7.04 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.274 -0.463 . . . . 0.0 111.418 -179.172 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.484 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 14.1 Cg_endo -56.82 -33.35 94.34 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.121 2.547 . . . . 0.0 113.3 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.33 -43.17 98.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.134 0.492 . . . . 0.0 110.912 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.53 -46.77 86.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.642 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.88 ' HA ' HG11 ' A' ' 56' ' ' VAL . 0.4 OUTLIER -54.52 -51.88 63.75 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 121.036 0.445 . . . . 0.0 110.045 179.937 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.01 -42.07 75.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.058 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.503 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 25.1 tttm -61.96 -35.07 77.36 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 120.946 0.403 . . . . 0.0 110.989 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -70.68 -40.88 72.67 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.611 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.754 HD21 ' HA ' ' A' ' 53' ' ' ARG . 6.7 mp -70.24 -33.01 71.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.634 -179.616 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.53 ' HA ' ' HG2' ' A' ' 71' ' ' ARG . 12.1 pt20 -74.71 -48.3 26.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.836 0.35 . . . . 0.0 110.169 179.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.444 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 3.9 mm-40 -62.25 -34.03 75.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.491 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.466 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -68.94 -49.31 59.18 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.4 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.865 ' HB3' HD11 ' A' ' 49' ' ' ILE . 0.5 OUTLIER -55.48 -37.9 68.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.406 -179.999 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.54 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 36.8 mt-30 -71.56 -34.27 69.83 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -41.13 98.68 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.523 179.412 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 71' ' ' ARG . 5.4 mt -67.9 -45.15 75.21 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.22 0.533 . . . . 0.0 109.748 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -52.35 -41.93 63.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.662 -179.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.466 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 1.1 p -77.32 -50.58 12.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.584 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.722 HD11 HD13 ' A' ' 15' ' ' LEU . 4.0 mt -54.56 -37.73 65.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.068 -179.247 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.2 -27.39 59.58 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.57 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.4 t-20 -52.9 -50.29 82.36 Favored Pre-proline 0 CA--C 1.532 0.268 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.57 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 46.9 Cg_endo -68.8 -36.77 13.04 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.381 2.054 . . . . 0.0 112.609 -179.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.607 ' CD2' HD23 ' A' ' 22' ' ' LEU . 3.3 t80 -68.43 -54.42 17.22 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.008 0.433 . . . . 0.0 110.163 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 19.6 mt -57.15 -37.46 72.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.153 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.483 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -67.98 -40.74 83.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.848 0.356 . . . . 0.0 110.764 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 88' ' ' PHE . 0.1 OUTLIER -61.64 -39.63 91.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.038 0.447 . . . . 0.0 110.171 179.5 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.797 ' O ' HD13 ' A' ' 89' ' ' LEU . 1.2 t80 -77.53 -38.04 49.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.931 179.412 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.483 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 14.4 ptt180 -62.46 -47.95 81.78 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.482 ' HA ' ' HG2' ' A' ' 90' ' ' LYS . 0.4 OUTLIER -63.11 -39.81 95.78 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.264 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.432 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 6.1 t80 -64.56 -28.45 69.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.742 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.797 HD13 ' O ' ' A' ' 85' ' ' TYR . 6.1 mp -75.22 -44.83 44.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.899 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.482 ' HG2' ' HA ' ' A' ' 87' ' ' ASP . 1.6 ptpt -67.14 -34.45 77.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.739 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.4 -2.6 0.75 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -60.92 175.71 0.47 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 177.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -115.12 159.46 20.85 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.52 179.663 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.758 0.313 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.94 92.22 3.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.063 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.48 -25.48 25.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.006 0.432 . . . . 0.0 110.761 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.18 -46.31 84.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.691 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 40.0 m-20 -63.43 -53.06 58.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.364 179.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.504 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -61.93 -33.11 73.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.959 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -64.74 -42.04 95.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.93 0.395 . . . . 0.0 110.08 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.485 HD11 HE21 ' A' ' 55' ' ' GLN . 0.9 OUTLIER -63.14 -44.83 94.46 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.659 178.959 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.504 HD12 ' HA ' ' A' ' 8' ' ' LYS . 37.0 mt -60.52 -54.25 37.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.709 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.461 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 79.5 p -52.18 -41.98 63.08 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-O 120.828 0.347 . . . . 0.0 110.646 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.33 -40.91 83.36 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.033 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.459 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -68.62 -27.95 73.48 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 176.635 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.2 OUTLIER -71.22 -61.63 1.7 Allowed 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 114.478 -0.861 . . . . 0.0 111.166 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.589 ' O ' HG23 ' A' ' 20' ' ' VAL . 6.6 mmtm -59.19 -33.81 71.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.267 0.556 . . . . 0.0 109.951 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -62.69 -50.87 69.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.877 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.516 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -74.34 -41.75 60.55 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.849 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.409 ' HG ' ' HA ' ' A' ' 16' ' ' LYS . 80.2 p -62.27 -51.64 66.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.804 0.335 . . . . 0.0 110.662 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' ' 16' ' ' LYS . 54.2 t -65.86 -35.44 75.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.444 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.859 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 1.9 tp -68.9 -43.62 74.86 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.037 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.891 HD13 ' HB2' ' A' ' 81' ' ' PHE . 1.5 mt -69.41 -31.36 69.67 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.703 0.261 . . . . 0.0 111.703 -179.15 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -75.71 -28.94 58.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.484 ' C ' ' H ' ' A' ' 26' ' ' VAL . 4.1 mp0 -117.66 -51.53 2.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.324 0.583 . . . . 0.0 111.547 -179.454 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.859 ' HG3' ' O ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER 64.44 -36.18 0.18 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.778 179.074 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.505 HG23 ' C ' ' A' ' 25' ' ' GLN . 4.7 t 80.91 109.62 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.812 0.339 . . . . 0.0 110.359 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.517 ' CZ ' ' CE1' ' A' ' 85' ' ' TYR . 20.7 m-85 -129.63 106.8 8.98 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.754 0.788 . . . . 0.0 111.819 -178.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -113.28 170.3 8.32 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.323 178.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.46 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 0.7 OUTLIER -96.97 135.58 21.97 Favored Pre-proline 0 C--N 1.315 -0.921 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.459 179.567 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.46 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 42.9 Cg_endo -67.34 151.69 84.36 Favored 'Cis proline' 0 C--N 1.351 0.661 0 C-N-CA 123.79 -1.338 . . . . 0.0 112.528 -0.011 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 mt -95.06 142.75 27.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.24 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.596 HG22 ' HB2' ' A' ' 36' ' ' ASP . 13.8 p -78.59 146.51 7.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.239 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.1 p -79.73 171.69 14.79 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.077 0.465 . . . . 0.0 112.006 -178.317 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.6 ' O ' HG23 ' A' ' 38' ' ' VAL . 4.3 tt0 -63.52 -48.09 78.98 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.317 -178.774 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -59.24 -33.4 70.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.516 0.674 . . . . 0.0 110.117 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.914 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.1 m-20 -73.22 -33.25 65.25 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.055 178.121 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.544 ' HG3' ' CD2' ' A' ' 85' ' ' TYR . 0.0 OUTLIER -67.43 -47.27 70.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.451 178.27 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 34' ' ' GLU . 38.8 t -55.7 -46.52 79.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.299 179.281 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -44.52 88.18 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.914 HG23 ' O ' ' A' ' 36' ' ' ASP . 45.4 t -57.96 -48.15 84.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.54 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 37' ' ' MET . 43.1 t -59.91 -48.73 86.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.655 179.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.47 ' OE1' HG12 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -55.05 -45.08 75.25 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.324 179.77 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.599 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -66.41 -43.59 85.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.029 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.627 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 8.3 m0 -62.25 -43.31 99.11 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.175 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.495 ' HA ' HD12 ' A' ' 74' ' ' LEU . 16.7 mtm -67.75 -43.62 79.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.044 -178.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -72.65 -34.87 67.57 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.235 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.599 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -65.91 -42.98 89.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.033 179.158 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -67.3 -48.32 67.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.847 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.533 HG22 ' N ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -59.58 -55.42 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.405 -179.484 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.533 ' N ' HG22 ' A' ' 49' ' ' ILE . 11.0 t30 -60.15 -41.16 92.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.967 0.413 . . . . 0.0 110.907 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.498 ' CG ' ' OE1' ' A' ' 55' ' ' GLN . 6.3 t80 -62.33 -50.97 69.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.717 -179.324 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.459 ' OH ' ' HA3' ' A' ' 14' ' ' GLY . 17.4 m-85 -64.79 -30.78 71.8 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -178.424 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.691 ' HA ' HD21 ' A' ' 67' ' ' LEU . 2.1 mtt180 -58.97 -21.53 58.75 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 119.923 -0.711 . . . . 0.0 110.447 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -100.7 -18.7 16.39 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.498 ' OE1' ' CG ' ' A' ' 51' ' ' TYR . 2.5 mt-30 -93.6 47.15 1.22 Allowed 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 120.83 -0.348 . . . . 0.0 111.141 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.904 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -128.82 165.84 27.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.312 0.577 . . . . 0.0 112.3 -179.633 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.82 171.74 14.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.204 -0.907 . . . . 0.0 108.867 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 83.7 -170.83 48.58 Favored Glycine 0 CA--C 1.516 0.154 0 C-N-CA 120.202 -0.999 . . . . 0.0 113.018 179.43 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.23 145.51 73.91 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-O 120.661 0.267 . . . . 0.0 111.067 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.518 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 12.0 Cg_endo -55.03 -19.96 21.84 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.931 2.421 . . . . 0.0 112.794 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.34 -40.75 77.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.798 0.332 . . . . 0.0 110.972 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.36 -47.01 71.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.39 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.904 ' HA ' HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -60.17 -50.75 72.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.462 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -54.58 -41.18 69.57 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.999 -179.033 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -60.48 -49.74 76.34 Favored 'General case' 0 CA--C 1.523 -0.078 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.113 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.444 ' O ' ' HG2' ' A' ' 69' ' ' GLU . . . -57.2 -39.61 75.76 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.78 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.691 HD21 ' HA ' ' A' ' 53' ' ' ARG . 3.6 mp -68.77 -37.98 79.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.12 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -70.81 -46.45 62.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.904 0.383 . . . . 0.0 110.271 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 66' ' ' ALA . 8.7 pt-20 -62.19 -35.93 80.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.108 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.466 ' HA ' HD22 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -63.33 -49.52 73.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.74 179.404 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.7 ttt-85 -55.46 -46.28 76.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.792 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.413 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -68.11 -38.35 82.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.15 0.5 . . . . 0.0 110.127 179.403 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 3.1 tp10 -64.47 -35.92 82.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.64 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 45' ' ' MET . 0.1 OUTLIER -68.55 -46.31 69.82 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.282 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -52.57 -39.24 61.32 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.956 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.524 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 6.8 t -80.86 -48.61 12.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.811 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.462 ' O ' HD12 ' A' ' 22' ' ' LEU . 2.0 mt -58.18 -40.72 82.22 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.25 75.93 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.298 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.537 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.6 m-80 -51.03 -50.37 75.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -177.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 55.6 Cg_endo -69.87 -27.7 25.63 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.377 2.051 . . . . 0.0 113.139 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.891 ' HB2' HD13 ' A' ' 22' ' ' LEU . 1.2 t80 -65.49 -53.58 40.52 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.686 0.279 . . . . 0.0 111.123 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 61.5 mt -53.39 -29.88 37.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.762 0.315 . . . . 0.0 110.441 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.89 -42.1 63.95 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -58.39 -43.19 88.43 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.564 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.544 ' CD2' ' HG3' ' A' ' 37' ' ' MET . 0.4 OUTLIER -72.38 -34.83 68.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.474 179.84 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -45.74 89.6 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.595 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -71.58 -30.02 65.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.921 178.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -70.34 -29.25 65.9 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.155 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.406 HD13 ' CE1' ' A' ' 92' ' ' HIS . 1.9 mm? -76.2 -44.29 38.5 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.15 -33.62 73.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.499 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.3 p -60.62 -15.44 28.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.97 -178.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.406 ' CE1' HD13 ' A' ' 89' ' ' LEU . 22.4 m80 -52.71 175.33 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.475 ' HB3' HD12 ' A' ' 94' ' ' LEU . 6.8 mm-40 -77.3 144.17 38.29 Favored 'General case' 0 C--N 1.33 -0.242 0 O-C-N 122.132 -0.355 . . . . 0.0 110.89 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.558 HD12 ' N ' ' A' ' 94' ' ' LEU . 5.0 mp . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.861 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.976 0.417 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.4 pp -126.2 13.94 7.78 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.323 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.47 -27.33 51.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.805 0.336 . . . . 0.0 111.0 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.79 -48.27 81.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.435 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -62.81 -52.26 63.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.282 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.471 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -59.43 -28.32 66.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.015 179.732 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -71.55 -45.26 62.81 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.495 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.625 HD12 ' HD1' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -59.84 -46.64 88.61 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.327 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.628 HG13 HD21 ' A' ' 70' ' ' LEU . 3.7 tt -61.74 -53.73 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.828 179.208 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.484 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 8.0 t -57.38 -33.14 67.52 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-O 120.596 0.236 . . . . 0.0 111.478 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.29 78.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.287 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.457 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -71.74 -33.7 63.13 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 177.078 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.467 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.7 mm? -58.51 -61.16 2.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.093 -1.053 . . . . 0.0 109.51 178.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.732 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.4 OUTLIER -57.57 -35.48 70.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.219 0.533 . . . . 0.0 110.068 179.551 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.34 -48.57 80.7 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.536 179.31 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.527 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -70.57 -47.18 61.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.843 -179.944 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 89.3 p -55.49 -49.12 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.851 0.358 . . . . 0.0 110.709 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.732 HG23 ' O ' ' A' ' 16' ' ' LYS . 47.8 t -68.08 -31.72 53.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.597 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.947 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 6.2 tp -66.23 -45.69 79.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.825 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.754 HD22 ' CG ' ' A' ' 81' ' ' PHE . 8.2 mt -68.68 -38.93 80.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.222 -179.528 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.28 -27.37 32.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.823 0.344 . . . . 0.0 111.109 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.495 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -112.04 21.56 15.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.109 -179.783 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.66 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -66.25 37.25 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -179.199 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.66 ' O ' ' O ' ' A' ' 25' ' ' GLN . 6.1 m 15.24 125.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 179.281 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.413 ' HB3' ' CE2' ' A' ' 88' ' ' PHE . 17.8 m-85 -114.22 96.06 5.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.319 178.526 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -146.63 140.92 26.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.346 -179.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.451 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 1.3 p30 -61.1 144.24 91.29 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.863 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.451 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 56.4 Cg_endo -69.96 128.98 13.7 Favored 'Cis proline' 0 C--N 1.351 0.675 0 C-N-CA 123.5 -1.458 . . . . 0.0 112.418 -0.114 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.2 mt -72.56 127.3 32.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.971 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.555 HG12 ' OH ' ' A' ' 85' ' ' TYR . 9.6 p -73.42 142.29 15.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.31 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.0 t -79.86 172.5 13.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.154 0.502 . . . . 0.0 111.618 -178.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.893 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -66.52 -40.64 89.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.918 -179.017 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -66.16 -36.83 84.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.246 0.545 . . . . 0.0 110.246 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.898 ' O ' HG23 ' A' ' 40' ' ' VAL . 8.9 t0 -71.62 -35.47 70.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.485 178.766 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.823 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -68.37 -44.47 75.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.59 178.594 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 34' ' ' GLU . 60.9 t -56.25 -47.44 80.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.244 179.226 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -59.35 -46.74 87.79 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.049 179.262 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.898 HG23 ' O ' ' A' ' 36' ' ' ASP . 42.5 t -58.59 -44.59 89.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.532 179.466 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.823 HG23 ' O ' ' A' ' 37' ' ' MET . 30.9 t -62.98 -48.91 85.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.487 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.96 -44.11 70.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.49 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.474 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -67.63 -39.05 84.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.422 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.947 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 7.3 m0 -62.84 -44.98 94.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 53.2 mtm -67.13 -45.78 76.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.416 -178.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -66.52 -41.72 88.38 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.436 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.474 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.38 -43.35 92.91 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.875 179.177 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.507 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 7.1 m-85 -61.13 -52.0 66.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.61 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.521 HD12 ' HA ' ' A' ' 49' ' ' ILE . 0.2 OUTLIER -54.43 -55.17 16.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.228 -179.295 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.501 ' N ' HG22 ' A' ' 49' ' ' ILE . 28.7 t30 -64.74 -35.58 81.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.098 0.475 . . . . 0.0 110.234 179.231 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.458 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 6.3 t80 -64.8 -35.06 79.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.986 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.96 ' CD2' HD13 ' A' ' 70' ' ' LEU . 26.0 m-85 -75.78 -35.52 60.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.745 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.552 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.1 OUTLIER -60.65 -29.4 69.25 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.692 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -93.62 -14.8 26.04 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -178.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.543 ' HB3' HD21 ' A' ' 10' ' ' LEU . 2.1 mt-30 -104.89 43.72 1.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.564 ' HB ' ' CG ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -127.67 168.24 21.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.873 0.368 . . . . 0.0 111.02 178.982 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.6 p -139.4 171.25 14.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.825 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.65 -152.88 25.48 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.472 -0.871 . . . . 0.0 112.92 179.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.68 152.75 89.41 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-O 120.848 0.356 . . . . 0.0 111.163 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.515 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 43.7 Cg_endo -67.74 -22.33 43.58 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.737 2.291 . . . . 0.0 113.053 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -63.4 -42.02 98.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.668 -179.402 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.38 -39.73 81.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.257 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.564 ' CG ' ' HB ' ' A' ' 56' ' ' VAL . 1.2 mpt_? -59.32 -51.17 71.1 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.249 0.547 . . . . 0.0 109.595 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.97 -41.14 86.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.855 -179.577 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.502 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 9.9 tttp -68.04 -50.11 57.31 Favored 'General case' 0 C--N 1.338 0.092 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.585 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.61 -32.39 70.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.503 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.552 HD11 ' CB ' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -71.71 -40.17 69.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.435 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.534 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 3.0 pt20 -66.62 -36.84 83.56 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.534 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.2 tt0 -69.24 -35.09 75.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.002 179.259 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.96 HD13 ' CD2' ' A' ' 52' ' ' TYR . 4.0 mt -65.49 -49.27 69.68 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.45 -48.89 73.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.317 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.505 ' HG2' ' HA ' ' A' ' 69' ' ' GLU . 7.7 pt20 -64.14 -36.52 84.3 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 178.664 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 2.9 tp10 -63.08 -37.22 86.34 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.512 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.444 HD23 ' CE2' ' A' ' 18' ' ' PHE . 23.9 mt -68.16 -45.68 72.83 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.3 m120 -52.95 -38.46 62.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.863 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.441 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 5.6 t -80.86 -49.3 11.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.508 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.8 mt -56.44 -35.25 67.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.205 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.62 -31.67 62.06 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.558 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.2 t-20 -51.65 -50.16 78.81 Favored Pre-proline 0 CA--C 1.533 0.319 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.558 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 55.5 Cg_endo -69.84 -32.33 18.43 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.442 2.095 . . . . 0.0 113.119 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.754 ' CG ' HD22 ' A' ' 22' ' ' LEU . 6.2 t80 -65.89 -53.67 36.6 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.886 0.374 . . . . 0.0 110.914 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.6 mt -56.33 -31.31 63.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.756 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.421 ' O ' ' HG3' ' A' ' 86' ' ' ARG . . . -69.08 -46.18 68.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.834 0.35 . . . . 0.0 110.392 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -58.02 -42.47 85.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.698 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.555 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.5 OUTLIER -73.03 -33.55 65.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.0 -179.933 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.51 ' HG3' ' N ' ' A' ' 87' ' ' ASP . 0.0 OUTLIER -63.03 -39.4 94.62 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.935 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.51 ' N ' ' HG3' ' A' ' 86' ' ' ARG . 6.7 m-20 -72.8 -32.44 65.56 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.029 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.418 ' O ' ' CD2' ' A' ' 92' ' ' HIS . 7.7 t80 -71.14 -28.92 64.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.713 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp -78.43 -45.04 23.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.456 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.6 mmtt -76.5 -40.37 50.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.007 -178.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 36.4 m -71.83 -13.03 61.56 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.994 -179.049 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.418 ' CD2' ' O ' ' A' ' 88' ' ' PHE . 1.5 m-70 -57.97 104.92 0.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.917 0.389 . . . . 0.0 110.675 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.617 ' HB3' HD12 ' A' ' 94' ' ' LEU . 0.4 OUTLIER -50.97 138.36 19.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.432 0.634 . . . . 0.0 112.378 -178.222 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.617 HD12 ' HB3' ' A' ' 93' ' ' GLU . 1.4 mp . . . . . 0 C--O 1.248 1.003 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.97 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.683 HD12 ' HB3' ' A' ' 6' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.439 0 N-CA-C 111.638 0.236 . . . . 0.0 111.638 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.419 ' HG ' ' C ' ' A' ' 3' ' ' LEU . 0.1 OUTLIER 34.41 -79.01 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 179.783 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.587 ' N ' ' O ' ' A' ' 3' ' ' LEU . 0.1 OUTLIER -50.12 -31.02 12.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.588 -178.985 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.683 ' HB3' HD12 ' A' ' 3' ' ' LEU . . . -58.83 -45.43 90.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.846 0.355 . . . . 0.0 110.703 179.563 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -64.42 -47.93 77.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.22 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.5 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -61.46 -28.1 69.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.954 179.779 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.87 -45.25 52.11 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.47 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.506 HD11 ' HG3' ' A' ' 55' ' ' GLN . 10.6 tp -61.63 -46.38 90.03 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.106 0.479 . . . . 0.0 109.713 178.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.611 HD11 ' HG3' ' A' ' 69' ' ' GLU . 2.6 tt -61.36 -53.6 46.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.648 179.009 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.492 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 6.6 t -52.12 -33.09 38.33 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.909 0.385 . . . . 0.0 110.554 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -67.79 -41.72 82.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.75 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.533 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -70.88 -35.98 65.56 Favored Glycine 0 C--O 1.23 -0.141 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mp -59.75 -61.01 2.93 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 113.829 -1.186 . . . . 0.0 109.929 179.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.711 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.3 tptp -59.06 -37.09 76.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.229 0.538 . . . . 0.0 110.253 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 6.7 tp10 -61.3 -46.85 88.58 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.386 179.203 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.478 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.3 OUTLIER -71.12 -49.32 45.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.1 -179.781 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 91.3 p -55.85 -46.36 78.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.907 0.385 . . . . 0.0 110.419 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.711 HG23 ' O ' ' A' ' 16' ' ' LYS . 63.0 t -68.32 -32.91 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.392 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.66 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 6.6 tp -62.62 -45.98 90.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.793 0.33 . . . . 0.0 110.587 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.911 HD22 ' CG ' ' A' ' 81' ' ' PHE . 9.8 mt -72.95 -30.59 63.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.612 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -82.66 -30.14 29.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.542 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.491 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 5.4 mp0 -107.91 9.92 28.61 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -48.38 160.22 0.17 Allowed 'General case' 0 C--O 1.232 0.184 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 177.229 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 11.3 p -112.08 138.14 42.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 119.931 1.241 . . . . 0.0 110.158 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.455 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.4 m-85 -116.13 94.73 4.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.524 0.678 . . . . 0.0 110.591 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -149.64 147.64 28.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.422 -179.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.44 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 3.1 p30 -68.77 144.45 95.99 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.388 179.09 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.44 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 56.1 Cg_endo -70.01 127.13 10.57 Favored 'Cis proline' 0 C--N 1.349 0.578 0 C-N-CA 123.536 -1.443 . . . . 0.0 112.361 0.045 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.55 HD22 ' HE2' ' A' ' 88' ' ' PHE . 18.2 mt -73.58 128.4 35.4 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.817 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.406 HG12 ' OH ' ' A' ' 85' ' ' TYR . 7.2 p -73.15 140.38 17.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.777 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.7 p -80.04 173.77 12.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.107 0.48 . . . . 0.0 111.856 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.907 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -62.81 -44.38 96.32 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.082 -179.106 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.32 -36.89 84.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.124 0.488 . . . . 0.0 110.542 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.911 ' O ' HG23 ' A' ' 40' ' ' VAL . 2.4 m-20 -71.55 -36.49 70.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.343 178.656 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.418 ' O ' HG23 ' A' ' 41' ' ' VAL . 5.3 tpt -66.91 -45.0 79.31 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.436 178.433 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.907 HG23 ' O ' ' A' ' 34' ' ' GLU . 77.8 t -55.6 -45.91 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.16 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.026 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -45.45 91.1 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.049 0.452 . . . . 0.0 109.865 178.796 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.911 HG23 ' O ' ' A' ' 36' ' ' ASP . 36.7 t -55.64 -47.66 78.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.015 179.667 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 37' ' ' MET . 39.4 t -68.41 -41.69 83.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.799 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -56.24 -47.17 79.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.975 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.549 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 2.8 p30 -71.56 -34.66 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.246 179.539 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.66 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 2.5 m0 -61.76 -46.61 88.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.418 0.627 . . . . 0.0 110.26 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.474 ' HG2' ' N ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -70.91 -36.6 72.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.125 -178.918 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.474 ' N ' ' HG2' ' A' ' 45' ' ' MET . 5.0 t30 -73.6 -39.83 64.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.959 0.409 . . . . 0.0 109.936 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.549 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.88 -45.76 91.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.728 179.438 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.468 ' CE1' ' CZ ' ' A' ' 47' ' ' PHE . 6.8 m-85 -64.71 -46.23 83.19 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.644 179.753 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.43 HG22 HH12 ' A' ' 53' ' ' ARG . 3.5 mm -55.18 -55.17 17.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.147 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -68.76 -37.69 79.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.955 0.407 . . . . 0.0 110.921 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.446 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.7 t80 -61.93 -43.07 99.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.91 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.694 ' O ' HG22 ' A' ' 56' ' ' VAL . 24.0 m-85 -75.66 -30.86 59.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.94 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.651 ' HG3' HD21 ' A' ' 67' ' ' LEU . 27.0 ttm105 -61.57 -30.53 70.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.998 0.428 . . . . 0.0 110.411 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -103.49 -10.97 18.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.397 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.506 ' HG3' HD11 ' A' ' 10' ' ' LEU . 9.5 tp-100 -96.33 21.85 8.53 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.729 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -102.12 174.06 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.138 0.494 . . . . 0.0 111.638 -179.599 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.0 p -143.8 171.43 14.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.433 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 83.66 -151.74 28.15 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.302 -0.951 . . . . 0.0 113.08 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.458 ' O ' ' HD3' ' A' ' 63' ' ' ARG . 13.8 mm-40 -75.15 159.45 82.5 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-O 120.726 0.298 . . . . 0.0 111.158 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.435 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 42.2 Cg_endo -67.6 -29.06 37.22 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.794 2.329 . . . . 0.0 113.861 -178.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.538 ' HG2' ' N ' ' A' ' 62' ' ' GLU . 8.8 pm0 -66.16 -39.13 89.54 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.945 0.403 . . . . 0.0 111.021 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.538 ' N ' ' HG2' ' A' ' 61' ' ' GLN . 18.3 mt-10 -64.17 -46.68 82.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.19 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.729 ' HA ' HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.61 -50.89 68.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.222 0.534 . . . . 0.0 109.611 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -55.46 -41.68 73.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.67 -178.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.434 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 8.5 mttt -61.69 -49.93 74.52 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.477 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.425 ' HA ' ' HG2' ' A' ' 69' ' ' GLU . . . -57.4 -35.84 70.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.857 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.651 HD21 ' HG3' ' A' ' 53' ' ' ARG . 6.6 mp -68.78 -37.93 79.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.434 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.435 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 0.0 OUTLIER -70.68 -43.82 68.29 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 179.538 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.611 ' HG3' HD11 ' A' ' 11' ' ' ILE . 9.1 pt-20 -67.65 -26.55 66.28 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.244 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.424 HD22 ' HA ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -69.55 -49.49 53.85 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.443 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.39 -48.84 73.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.785 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.49 -33.88 73.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.164 0.507 . . . . 0.0 109.88 179.129 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -58.86 -48.23 82.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.656 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.481 HD23 ' N ' ' A' ' 74' ' ' LEU . 4.6 mt -67.45 -42.96 82.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.983 0.42 . . . . 0.0 110.341 178.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -52.29 -40.83 62.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.915 -179.136 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.7 m -81.0 -50.7 9.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.156 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.423 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 0.5 OUTLIER -57.0 -34.57 68.27 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.355 -179.07 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.3 -30.09 60.26 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 -178.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.567 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -51.74 -49.74 81.56 Favored Pre-proline 0 CA--C 1.535 0.389 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.237 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.567 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.5 Cg_endo -69.54 -36.63 11.04 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.416 2.077 . . . . 0.0 113.235 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.911 ' CG ' HD22 ' A' ' 22' ' ' LEU . 13.6 t80 -65.04 -53.63 42.86 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.992 0.425 . . . . 0.0 110.415 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 20.1 mt -58.2 -29.43 65.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.588 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -66.41 -48.87 68.68 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 110.155 179.203 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -57.21 -49.14 76.93 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.567 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.406 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -67.74 -33.41 74.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.693 179.854 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.69 -38.07 88.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.163 0.506 . . . . 0.0 109.654 178.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.84 -31.08 64.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.739 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.581 ' CE1' ' ND1' ' A' ' 92' ' ' HIS . 9.1 t80 -73.23 -37.25 66.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.452 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -79.25 -44.65 21.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.131 178.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 3.0 mmtp -72.23 -36.11 69.02 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -177.044 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 m -110.47 -28.61 8.45 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -178.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.581 ' ND1' ' CE1' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -84.62 157.89 21.04 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.788 0.804 . . . . 0.0 112.671 -177.861 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.438 ' O ' ' CE1' ' A' ' 92' ' ' HIS . 0.1 OUTLIER -113.15 152.93 29.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.34 -1.3 . . . . 0.0 110.612 179.591 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.968 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 3' ' ' LEU . 3.7 mm? . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.771 0.319 . . . . 0.0 111.156 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.55 HD12 ' H ' ' A' ' 7' ' ' ASN . 0.2 OUTLIER -56.98 157.24 5.92 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.773 179.824 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 tttm -77.08 -32.95 57.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.336 -179.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.52 -48.4 80.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.795 0.331 . . . . 0.0 111.114 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.55 ' H ' HD12 ' A' ' 4' ' ' LEU . 0.7 OUTLIER -62.34 -52.9 61.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.933 0.397 . . . . 0.0 110.27 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -59.49 -28.27 66.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.734 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -70.63 -45.15 65.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.598 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.82 HD11 ' CG ' ' A' ' 55' ' ' GLN . 0.3 OUTLIER -60.07 -46.18 90.44 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.273 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.74 HG22 HD12 ' A' ' 15' ' ' LEU . 41.1 mm -61.82 -54.28 36.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.079 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.0 t -61.31 -33.07 72.99 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.69 -43.93 75.04 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.945 -179.051 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.695 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -70.85 -42.3 61.05 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 177.255 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.74 HD12 HG22 ' A' ' 11' ' ' ILE . 2.1 mt -54.34 -58.7 6.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 113.813 -1.193 . . . . 0.0 109.745 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.533 ' O ' HG23 ' A' ' 20' ' ' VAL . 48.7 tttm -61.77 -31.97 72.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.139 0.495 . . . . 0.0 109.851 179.318 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.49 -48.54 80.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.252 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.792 ' CE2' HD23 ' A' ' 74' ' ' LEU . 0.5 OUTLIER -72.82 -50.24 25.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.754 -179.904 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.435 ' HA ' HD12 ' A' ' 22' ' ' LEU . 11.1 m -55.41 -51.31 67.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.987 0.423 . . . . 0.0 110.173 179.619 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 16' ' ' LYS . 95.6 t -65.03 -32.39 58.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.233 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.601 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 3.7 tp -64.19 -45.92 86.22 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.612 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.559 HD22 ' HB2' ' A' ' 81' ' ' PHE . 1.7 mt -66.65 -36.01 81.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.008 0.432 . . . . 0.0 110.129 179.683 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -82.59 -18.18 42.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.188 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.405 ' N ' ' O ' ' A' ' 20' ' ' VAL . 22.1 mt-30 -107.48 12.24 28.03 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.502 ' HG3' ' CZ ' ' A' ' 81' ' ' PHE . 1.9 mm-40 -50.14 161.97 0.24 Allowed 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 178.003 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.5 t -109.23 132.08 58.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 119.107 0.867 . . . . 0.0 111.102 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.412 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 5.4 m-85 -107.37 131.49 54.19 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.71 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.567 ' O ' ' O ' ' A' ' 30' ' ' PRO . 1.6 m120 -149.62 147.12 27.75 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.74 -179.205 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.585 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 2.5 p30 -114.3 125.13 29.65 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 114.997 -1.002 . . . . 0.0 109.92 178.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.585 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 14.0 Cg_endo -56.26 167.82 10.0 Favored 'Cis proline' 0 C--N 1.356 0.925 0 C-N-CA 124.483 -1.049 . . . . 0.0 112.677 0.423 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 28' ' ' ASN . 6.4 mt -110.98 148.38 32.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.335 -179.687 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.423 HG12 ' OH ' ' A' ' 85' ' ' TYR . 10.2 p -73.88 154.23 6.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.84 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.81 170.06 17.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.253 0.549 . . . . 0.0 112.117 -178.276 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.887 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -68.3 -29.52 68.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.591 -179.2 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -34.06 76.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.077 0.465 . . . . 0.0 110.279 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.882 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.3 OUTLIER -71.7 -40.78 69.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.917 179.232 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.807 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -64.63 -45.59 86.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.754 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 34' ' ' GLU . 48.1 t -55.66 -48.16 78.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.875 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.41 HG22 ' O ' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -62.23 -44.86 95.6 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.228 179.638 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.882 HG23 ' O ' ' A' ' 36' ' ' ASP . 53.4 t -59.05 -43.61 89.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.684 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.807 HG23 ' O ' ' A' ' 37' ' ' MET . 35.6 t -67.08 -48.83 77.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.57 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -50.86 71.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.381 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.51 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.7 OUTLIER -60.14 -41.64 93.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.168 179.316 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.601 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 8.4 m0 -60.75 -43.75 97.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.409 179.372 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.586 ' HG3' HD13 ' A' ' 74' ' ' LEU . 0.4 OUTLIER -61.54 -50.67 71.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.228 -178.954 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -68.32 -36.84 79.9 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.51 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.75 -41.15 90.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.783 179.177 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.468 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 4.8 m-85 -70.78 -48.37 54.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.835 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.451 HD13 ' HA ' ' A' ' 49' ' ' ILE . 4.5 mm -53.86 -55.05 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.302 -179.001 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -68.65 -34.52 75.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.838 0.352 . . . . 0.0 110.966 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.454 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 3.0 t80 -65.36 -44.34 87.95 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.938 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.716 ' O ' HG22 ' A' ' 56' ' ' VAL . 58.8 m-85 -75.43 -33.39 60.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.59 -179.426 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.794 ' HA ' HD11 ' A' ' 67' ' ' LEU . 29.7 ttm-85 -61.38 -31.22 71.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.664 0.269 . . . . 0.0 111.476 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -96.2 -9.54 30.24 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.82 ' CG ' HD11 ' A' ' 10' ' ' LEU . 4.0 pt20 -113.48 35.47 4.01 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -178.602 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.716 HG22 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -111.75 156.33 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 177.786 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.4 p -122.25 169.84 10.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.82 0.343 . . . . 0.0 110.883 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 91.19 -152.35 21.58 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.505 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.95 163.73 66.19 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 120.765 0.316 . . . . 0.0 110.885 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.44 -27.72 39.58 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.616 2.21 . . . . 0.0 112.547 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.07 -41.91 94.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.96 0.409 . . . . 0.0 110.92 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.77 -46.65 84.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.467 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.469 ' HD3' ' HB ' ' A' ' 56' ' ' VAL . 17.4 mtt85 -55.32 -51.18 67.58 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.255 0.55 . . . . 0.0 109.865 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -55.83 -41.45 74.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.541 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -60.18 -49.9 75.79 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.06 0.457 . . . . 0.0 110.3 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.19 68.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.413 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.794 HD11 ' HA ' ' A' ' 53' ' ' ARG . 4.5 mp -67.5 -39.98 85.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.401 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -70.29 -45.67 65.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.123 0.487 . . . . 0.0 110.012 179.458 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.435 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 2.7 mt-10 -62.87 -32.93 74.27 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.239 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.691 HD11 ' CE2' ' A' ' 52' ' ' TYR . 0.3 OUTLIER -65.97 -49.32 68.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.148 0.499 . . . . 0.0 109.683 179.247 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.419 ' HA ' HD12 ' A' ' 74' ' ' LEU . 2.3 tmm_? -55.26 -46.18 76.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.728 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.463 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -69.43 -31.89 70.51 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.089 0.471 . . . . 0.0 110.068 179.09 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.463 ' N ' ' HG3' ' A' ' 72' ' ' GLN . 1.0 OUTLIER -61.82 -45.97 91.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.839 179.584 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.792 HD23 ' CE2' ' A' ' 18' ' ' PHE . 1.8 mt -67.36 -44.69 78.39 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 121.157 0.503 . . . . 0.0 110.315 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 26.6 m120 -52.46 -41.2 63.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.855 -179.357 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.402 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -80.84 -50.56 9.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.037 179.615 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.513 HD22 ' CD1' ' A' ' 22' ' ' LEU . 4.7 mt -56.21 -34.58 66.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.062 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.08 -28.98 61.64 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.569 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 10.6 t30 -53.84 -50.28 84.67 Favored Pre-proline 0 C--N 1.328 -0.333 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.3 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 42.1 Cg_endo -68.29 -39.37 10.16 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.474 2.116 . . . . 0.0 113.222 -179.358 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.559 ' HB2' HD22 ' A' ' 22' ' ' LEU . 5.7 t80 -63.81 -53.53 49.35 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.231 0.538 . . . . 0.0 110.565 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.441 HD21 HG21 ' A' ' 41' ' ' VAL . 88.3 mt -57.57 -31.5 66.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.794 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.477 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -68.3 -45.2 73.66 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.961 0.41 . . . . 0.0 110.772 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -59.62 -41.86 91.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.059 0.457 . . . . 0.0 110.587 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.438 ' O ' ' HG ' ' A' ' 89' ' ' LEU . 0.2 OUTLIER -77.57 -35.71 52.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.691 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 22.3 ptt180 -64.17 -39.49 94.12 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.568 -0.453 . . . . 0.0 109.819 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.59 -36.99 68.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.72 178.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.509 ' O ' ' ND1' ' A' ' 92' ' ' HIS . 4.5 t80 -69.6 -29.24 66.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.486 179.098 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 85' ' ' TYR . 6.2 mt -79.17 -45.26 20.29 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.479 178.412 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.92 -31.34 72.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.151 -178.71 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -81.93 5.79 17.94 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.509 ' ND1' ' O ' ' A' ' 88' ' ' PHE . 13.1 m80 -72.04 104.06 3.45 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.676 -179.369 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -51.55 115.57 1.68 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.169 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.901 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.476 HD23 ' O ' ' A' ' 4' ' ' LEU . 6.6 tt . . . . . 0 N--CA 1.487 1.39 0 CA-C-O 120.877 0.37 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.476 ' O ' HD23 ' A' ' 3' ' ' LEU . 3.0 mt 58.85 162.92 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.983 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.0 mtmt -60.5 -20.11 59.07 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.017 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.15 -45.75 75.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.052 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.48 -50.61 69.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.273 179.379 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.61 -33.31 71.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.551 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.77 -44.51 89.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.086 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.493 HD22 ' HA ' ' A' ' 10' ' ' LEU . 0.3 OUTLIER -59.91 -46.54 89.04 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.226 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.747 HD13 ' HE2' ' A' ' 52' ' ' TYR . 35.3 mm -57.79 -53.75 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.821 178.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.508 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 25.1 p -53.0 -42.87 66.02 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.285 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.4 91.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.557 0.218 . . . . 0.0 111.261 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.458 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.91 -28.03 72.38 Favored Glycine 0 CA--C 1.518 0.227 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 177.219 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.577 HD12 HG22 ' A' ' 11' ' ' ILE . 0.4 OUTLIER -67.35 -61.48 1.89 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.211 -0.994 . . . . 0.0 110.691 179.452 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.761 ' O ' HG23 ' A' ' 20' ' ' VAL . 5.1 mmtt -59.69 -39.18 83.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.308 0.575 . . . . 0.0 109.634 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -59.37 -50.64 73.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.956 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.534 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -69.85 -42.7 73.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.985 -179.756 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.46 -51.06 71.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.991 0.424 . . . . 0.0 110.426 179.462 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.761 HG23 ' O ' ' A' ' 16' ' ' LYS . 61.1 t -63.29 -33.55 61.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.657 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.953 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 34.9 tp -62.37 -46.14 89.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.826 0.346 . . . . 0.0 110.777 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.832 HD22 ' CG ' ' A' ' 81' ' ' PHE . 36.7 mt -66.25 -41.29 90.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.073 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -80.03 -21.21 43.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.429 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.484 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -117.55 21.48 12.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.223 -179.691 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.653 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.1 OUTLIER -66.93 36.55 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.118 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.653 ' O ' ' O ' ' A' ' 25' ' ' GLN . 22.4 m 8.45 127.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -107.33 100.47 9.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.211 178.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -113.53 148.48 35.99 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.587 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.479 ' HA ' ' N ' ' A' ' 31' ' ' LEU . 0.6 OUTLIER -92.76 148.14 35.45 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.799 179.821 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.02 116.07 4.11 Favored 'Cis proline' 0 C--N 1.349 0.56 0 C-N-CA 123.39 -1.504 . . . . 0.0 112.263 -0.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.876 HD13 ' CE1' ' A' ' 92' ' ' HIS . 1.0 OUTLIER -38.63 140.12 0.36 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.172 -179.253 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.597 HG12 ' OH ' ' A' ' 85' ' ' TYR . 11.1 p -76.46 152.67 5.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.024 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.0 m -79.97 172.19 14.1 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.204 0.526 . . . . 0.0 111.912 -178.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.91 ' O ' HG23 ' A' ' 38' ' ' VAL . 2.0 mp0 -66.64 -40.74 88.84 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.221 -178.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -37.01 85.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.109 0.48 . . . . 0.0 110.461 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.883 ' O ' HG23 ' A' ' 40' ' ' VAL . 5.0 m-20 -71.91 -35.73 69.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.511 178.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.601 ' O ' HG23 ' A' ' 41' ' ' VAL . 5.5 tpt -67.16 -45.55 76.7 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.506 178.594 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.91 HG23 ' O ' ' A' ' 34' ' ' GLU . 49.1 t -55.67 -46.74 79.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.232 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -46.87 85.01 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.162 179.084 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 36' ' ' ASP . 25.5 t -55.83 -51.52 59.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.651 179.367 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 37' ' ' MET . 32.0 t -58.08 -46.42 88.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.544 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.71 -47.09 74.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.466 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.544 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 1.0 OUTLIER -56.83 -48.58 77.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.948 179.833 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.953 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 33.2 m0 -60.76 -42.27 97.12 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.122 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.709 ' HG3' HD13 ' A' ' 74' ' ' LEU . 2.9 ttp -61.86 -50.96 70.17 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.196 -0.457 . . . . 0.0 112.042 -178.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -72.62 -29.6 63.61 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.017 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.544 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 1.1 t80 -64.02 -45.47 88.78 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.832 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -69.49 -42.62 74.53 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.306 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 15.1 mm -54.14 -55.29 15.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.197 -179.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.547 ' HA ' ' HG2' ' A' ' 53' ' ' ARG . 13.0 m-80 -66.64 -34.87 78.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.301 0.572 . . . . 0.0 110.171 179.397 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.479 ' HB2' ' O ' ' A' ' 47' ' ' PHE . 6.6 t80 -62.78 -40.22 96.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.044 179.715 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.934 ' O ' HG23 ' A' ' 56' ' ' VAL . 5.3 m-85 -75.47 -38.71 59.43 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -178.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.547 ' HG2' ' HA ' ' A' ' 50' ' ' ASN . 4.8 ptp85 -58.75 -31.64 68.52 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.122 -179.393 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -91.49 -11.38 37.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.591 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.469 ' HG2' ' CE1' ' A' ' 51' ' ' TYR . 2.5 mp0 -96.58 -18.62 19.64 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.134 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.934 HG23 ' O ' ' A' ' 52' ' ' TYR . 14.5 t -68.78 160.39 4.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.08 0.467 . . . . 0.0 111.886 -179.257 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.537 ' N ' HG12 ' A' ' 56' ' ' VAL . 19.4 p -133.88 171.11 14.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.509 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 90.9 -151.08 20.95 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.934 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.401 ' O ' ' HD2' ' A' ' 63' ' ' ARG . 0.5 OUTLIER -78.11 162.91 65.25 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.707 0.289 . . . . 0.0 110.984 -179.853 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -60.98 -28.34 86.14 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.715 2.277 . . . . 0.0 112.761 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -43.29 99.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.131 0.491 . . . . 0.0 110.679 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.23 -46.66 88.99 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.211 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.613 ' HG3' ' HB ' ' A' ' 56' ' ' VAL . 3.7 mpt_? -54.04 -51.19 64.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.05 0.452 . . . . 0.0 110.014 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.43 -41.97 73.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.314 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.421 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 2.2 ttmm -66.66 -32.06 73.14 Favored 'General case' 0 CA--C 1.523 -0.069 0 O-C-N 122.082 -0.386 . . . . 0.0 110.852 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -71.07 -38.33 72.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.464 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.541 HD21 ' HB3' ' A' ' 53' ' ' ARG . 8.9 mp -70.03 -35.05 74.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.588 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 3.3 pp0? -73.81 -46.35 45.81 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.373 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -62.34 -35.65 79.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.522 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.441 HD21 ' CD1' ' A' ' 52' ' ' TYR . 2.1 tp -66.09 -49.02 69.02 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.111 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -55.23 -45.65 75.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.796 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.04 -33.53 65.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.041 0.448 . . . . 0.0 110.056 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.447 ' O ' HG22 ' A' ' 76' ' ' THR . 0.4 OUTLIER -60.77 -48.0 83.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.752 179.808 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.709 HD13 ' HG3' ' A' ' 45' ' ' MET . 4.5 mt -67.67 -44.8 76.96 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.931 0.396 . . . . 0.0 110.535 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -52.69 -40.17 62.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.326 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.447 HG22 ' O ' ' A' ' 73' ' ' GLU . 12.1 t -80.87 -34.73 33.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.265 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.431 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 0.6 OUTLIER -72.97 -30.16 63.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.996 -179.276 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.26 -29.4 60.16 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.569 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 15.3 m-20 -54.76 -50.23 87.06 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.2 Cg_endo -69.78 -37.87 8.52 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.459 2.106 . . . . 0.0 112.74 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.832 ' CG ' HD22 ' A' ' 22' ' ' LEU . 1.8 t80 -62.75 -53.42 54.58 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 110.415 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 93.2 mt -55.03 -27.64 46.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.283 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.47 -45.46 62.49 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.457 179.265 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 80' ' ' PRO . 7.6 mttt -56.86 -42.94 80.65 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.146 0.498 . . . . 0.0 109.925 179.267 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.597 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.2 OUTLIER -75.34 -33.39 61.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.445 179.143 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -44.49 96.28 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.476 ' HA ' ' HG2' ' A' ' 90' ' ' LYS . 1.0 OUTLIER -71.24 -33.55 69.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.007 178.99 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.415 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 2.9 t80 -71.49 -28.91 64.24 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.017 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.739 HD12 ' OE1' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -78.68 -45.36 21.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.421 179.287 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.476 ' HG2' ' HA ' ' A' ' 87' ' ' ASP . 11.4 pttp -73.83 -37.93 64.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.216 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.4 t -75.22 -11.29 60.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.525 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.876 ' CE1' HD13 ' A' ' 31' ' ' LEU . 2.3 m170 -66.94 105.05 1.51 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.985 0.422 . . . . 0.0 110.98 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -121.62 111.97 17.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.264 178.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mt . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.299 -0.857 . . . . 0.0 110.937 -179.948 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.691 HD12 ' HG ' ' A' ' 4' ' ' LEU . 2.3 pp . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 120.736 0.303 . . . . 0.0 111.252 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.691 ' HG ' HD12 ' A' ' 3' ' ' LEU . 5.5 mt -145.44 101.72 3.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.114 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -55.02 -30.0 58.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.133 0.492 . . . . 0.0 110.534 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.22 -44.97 75.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.796 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.07 -50.88 66.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.179 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -34.48 71.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.568 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -65.15 -42.63 93.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.155 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.967 HD13 ' CE2' ' A' ' 52' ' ' TYR . 0.2 OUTLIER -59.72 -48.22 82.53 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.717 179.324 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.642 HG22 HD13 ' A' ' 15' ' ' LEU . 41.0 mm -59.13 -53.79 43.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.073 178.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 72.3 m -57.21 -33.11 67.18 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.011 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.17 91.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.183 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.508 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.75 -41.87 72.7 Favored Glycine 0 CA--C 1.511 -0.201 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 177.149 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.642 HD13 HG22 ' A' ' 11' ' ' ILE . 0.9 OUTLIER -54.4 -58.9 5.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 113.824 -1.188 . . . . 0.0 109.624 178.824 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.707 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -59.68 -30.92 69.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.373 179.465 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.33 -47.26 74.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.449 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.553 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -71.32 -46.11 61.42 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.71 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 82.9 p -55.51 -51.6 66.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 0.0 110.749 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.707 HG23 ' O ' ' A' ' 16' ' ' LYS . 48.3 t -66.59 -33.27 62.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.967 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.883 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 2.6 tp -66.76 -45.78 77.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.01 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.784 HD22 ' HB2' ' A' ' 81' ' ' PHE . 4.5 mt -68.23 -35.11 77.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.855 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.47 -34.24 31.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.91 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.66 ' O ' HG23 ' A' ' 26' ' ' VAL . 4.8 tt0 -104.8 18.81 21.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.233 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.497 ' O ' HG23 ' A' ' 26' ' ' VAL . 0.0 OUTLIER -39.37 -59.37 1.08 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.762 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 24' ' ' GLN . 42.4 t 98.92 130.19 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.534 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.448 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.1 m-85 -122.19 96.18 4.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.979 -179.657 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -143.71 137.65 28.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.02 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.94 144.13 68.94 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.839 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.84 126.79 12.2 Favored 'Cis proline' 0 C--N 1.349 0.571 0 C-N-CA 123.432 -1.487 . . . . 0.0 112.349 0.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.499 HD22 ' HE2' ' A' ' 88' ' ' PHE . 3.9 mt -70.74 123.79 22.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.114 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 11.6 p -74.55 144.92 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.825 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.86 173.36 12.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.085 0.469 . . . . 0.0 111.734 -178.68 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.88 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.1 OUTLIER -64.61 -42.81 95.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.141 -179.121 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -66.07 -37.25 85.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.071 0.462 . . . . 0.0 110.756 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.874 ' O ' HG23 ' A' ' 40' ' ' VAL . 3.9 m-20 -71.57 -37.84 71.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.819 179.046 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.765 ' O ' HG23 ' A' ' 41' ' ' VAL . 1.4 tpt -67.91 -45.14 75.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.704 178.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 34' ' ' GLU . 96.1 t -56.41 -44.14 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.448 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -45.57 92.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.924 0.392 . . . . 0.0 110.142 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.874 HG23 ' O ' ' A' ' 36' ' ' ASP . 39.2 t -60.11 -44.23 94.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.533 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.765 HG23 ' O ' ' A' ' 37' ' ' MET . 38.8 t -65.06 -49.11 81.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.62 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.83 -42.94 80.54 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.237 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.402 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -60.26 -41.0 92.33 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.071 0.462 . . . . 0.0 109.774 179.022 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.883 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 10.7 m0 -60.52 -39.35 87.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.249 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.524 ' HA ' HD12 ' A' ' 74' ' ' LEU . 52.0 mtm -68.07 -45.99 72.3 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -178.579 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.02 -34.35 73.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.03 0.443 . . . . 0.0 110.07 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.449 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -62.8 -46.19 89.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.098 179.32 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -66.61 -47.39 72.79 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.12 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.43 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.3 OUTLIER -55.31 -55.09 18.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.027 -179.681 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.496 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 8.0 m-80 -66.68 -36.85 83.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.131 0.491 . . . . 0.0 110.727 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.449 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 4.7 t80 -64.65 -39.27 93.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.142 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.967 ' CE2' HD13 ' A' ' 10' ' ' LEU . 7.5 m-85 -75.64 -36.75 60.1 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.815 ' HB3' HD21 ' A' ' 67' ' ' LEU . 8.8 ptp180 -58.13 -28.48 64.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.089 0.471 . . . . 0.0 110.8 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -95.49 -8.57 34.91 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.596 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 29.3 tp60 -95.7 -7.83 36.3 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.634 ' HB ' ' HD2' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -85.14 178.29 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.172 0.511 . . . . 0.0 111.715 -178.962 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.0 p -144.91 171.4 14.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.288 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.85 -144.85 19.72 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.901 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -79.17 163.69 58.48 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.724 0.297 . . . . 0.0 110.975 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.474 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 45.4 Cg_endo -67.7 -22.74 43.22 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.666 2.244 . . . . 0.0 112.777 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.17 -43.13 92.71 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.938 0.399 . . . . 0.0 110.733 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -60.82 -44.58 96.73 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.081 179.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.634 ' HD2' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.52 -50.96 68.6 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.225 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -55.28 -41.94 72.95 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.535 -178.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.461 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 0.8 OUTLIER -66.33 -34.41 77.93 Favored 'General case' 0 C--O 1.231 0.101 0 O-C-N 122.103 -0.373 . . . . 0.0 110.955 -179.819 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.487 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -69.48 -38.48 77.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.089 0.471 . . . . 0.0 110.032 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.815 HD21 ' HB3' ' A' ' 53' ' ' ARG . 8.1 mp -68.45 -35.94 78.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.395 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 18.8 pt20 -76.08 -48.91 19.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.811 0.338 . . . . 0.0 110.815 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.44 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.2 mt-10 -61.98 -41.98 98.63 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.519 -179.543 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.551 HD22 ' CD2' ' A' ' 52' ' ' TYR . 9.5 tp -66.68 -49.1 67.2 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.73 -43.27 76.44 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.431 179.531 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.4 -41.25 76.67 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.158 0.504 . . . . 0.0 109.65 179.111 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 3.2 tp10 -58.55 -39.41 80.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.601 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.524 HD12 ' HA ' ' A' ' 45' ' ' MET . 1.3 mt -67.98 -45.53 73.91 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.202 0.525 . . . . 0.0 109.813 178.149 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -52.52 -37.19 56.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.563 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.425 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -80.83 -50.6 9.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.69 179.148 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.474 HD22 ' CD1' ' A' ' 22' ' ' LEU . 3.8 mt -57.81 -35.02 70.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.506 -178.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.16 -30.89 60.86 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.565 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.0 OUTLIER -51.52 -49.97 79.48 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.086 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.565 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 51.1 Cg_endo -69.4 -34.1 16.52 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.43 2.087 . . . . 0.0 112.961 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.784 ' HB2' HD22 ' A' ' 22' ' ' LEU . 3.3 t80 -66.97 -53.85 27.64 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.902 0.382 . . . . 0.0 110.22 179.649 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 90.6 mt -60.6 -27.57 67.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.783 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.529 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -70.25 -42.67 71.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.051 0.453 . . . . 0.0 110.465 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.69 -42.9 94.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.299 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -72.66 -42.71 64.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.519 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.529 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 9.1 ptm180 -59.84 -35.4 74.67 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.449 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.507 ' HA ' ' HG2' ' A' ' 90' ' ' LYS . 0.1 OUTLIER -72.55 -35.32 67.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.343 178.141 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.499 ' HE2' HD22 ' A' ' 31' ' ' LEU . 15.1 t80 -69.89 -28.55 65.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.004 179.198 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.24 -45.52 22.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.141 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.507 ' HG2' ' HA ' ' A' ' 87' ' ' ASP . 17.3 ptpt -72.83 -35.54 67.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.968 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.422 ' N ' ' HG3' ' A' ' 90' ' ' LYS . 68.2 m -86.71 -6.86 58.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.487 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 110.18 0.96 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.903 0.382 . . . . 0.0 110.856 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -121.24 109.96 15.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.354 178.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.145 -0.931 . . . . 0.0 110.906 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.719 ' N ' HD13 ' A' ' 3' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 120.824 0.345 . . . . 0.0 111.353 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.57 -32.15 25.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.126 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.67 -33.2 54.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.94 0.4 . . . . 0.0 110.82 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.617 ' H ' HD23 ' A' ' 3' ' ' LEU . . . -60.37 -45.51 93.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.718 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -64.71 -45.82 84.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.49 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.639 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.6 OUTLIER -64.44 -34.38 78.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.713 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.92 -45.0 83.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.48 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.473 HD21 ' HD1' ' A' ' 52' ' ' TYR . 2.7 tp -60.81 -46.09 91.88 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.211 0.529 . . . . 0.0 109.691 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.639 HD12 ' HA ' ' A' ' 8' ' ' LYS . 12.9 mt -60.48 -53.81 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.962 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.435 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 4.1 m -55.2 -33.65 63.22 Favored 'General case' 0 C--O 1.227 -0.107 0 CA-C-O 120.912 0.387 . . . . 0.0 110.468 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.06 -41.34 95.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.588 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.494 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -70.39 -40.41 69.09 Favored Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 109.126 -1.59 . . . . 0.0 109.126 176.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.605 HD13 HG22 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -54.64 -60.02 3.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.908 -1.146 . . . . 0.0 110.454 179.135 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.665 ' O ' HG23 ' A' ' 20' ' ' VAL . 15.7 tttm -60.8 -34.65 74.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.164 0.507 . . . . 0.0 110.092 179.723 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.44 -47.76 84.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.214 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.563 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -69.81 -50.31 44.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.852 -179.76 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.612 ' HA ' HD12 ' A' ' 22' ' ' LEU . 61.6 m -55.44 -51.6 66.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.05 0.452 . . . . 0.0 110.836 179.871 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.665 HG23 ' O ' ' A' ' 16' ' ' LYS . 58.3 t -63.66 -33.76 63.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.646 179.598 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.88 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 1.0 OUTLIER -66.24 -45.95 78.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.647 179.878 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.821 HD22 ' HB2' ' A' ' 81' ' ' PHE . 2.6 mt -61.93 -37.75 85.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.015 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -82.52 -19.29 38.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.034 179.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.432 ' HG3' ' HA ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -109.58 21.28 17.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.425 -179.683 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.801 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.8 OUTLIER -74.31 29.45 0.08 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.295 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.801 ' O ' ' O ' ' A' ' 25' ' ' GLN . 22.9 t 19.78 133.31 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 N-CA-C 113.815 1.042 . . . . 0.0 113.815 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -114.04 95.85 5.51 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.245 0.545 . . . . 0.0 110.804 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -142.42 142.76 32.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.761 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.583 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 2.4 m-20 -78.2 159.06 76.2 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.867 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.583 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 20.3 Cg_endo -60.65 139.42 24.04 Favored 'Cis proline' 0 C--N 1.352 0.747 0 C-N-CA 123.625 -1.406 . . . . 0.0 112.229 -0.045 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.74 HD13 ' CE1' ' A' ' 92' ' ' HIS . 9.8 mt -76.7 123.69 26.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.116 -179.467 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.529 HG12 ' OH ' ' A' ' 85' ' ' TYR . 11.5 p -74.82 148.04 8.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.86 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.8 m -79.88 172.46 13.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.073 0.463 . . . . 0.0 111.671 -178.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.846 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -70.32 -29.34 66.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.355 -179.442 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.56 -36.57 78.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.983 0.42 . . . . 0.0 110.436 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.895 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.6 OUTLIER -74.11 -36.68 64.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.912 -0.586 . . . . 0.0 109.703 178.938 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.824 ' O ' HG23 ' A' ' 41' ' ' VAL . 2.5 tpt -67.74 -47.29 69.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.615 178.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.846 HG23 ' O ' ' A' ' 34' ' ' GLU . 92.3 t -56.27 -46.06 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.167 179.287 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -58.36 -47.15 84.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.137 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 36' ' ' ASP . 42.6 t -59.0 -40.92 81.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.759 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 37' ' ' MET . 20.3 t -67.32 -48.88 76.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.696 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.96 -46.27 78.63 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.529 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -64.39 -41.14 96.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.55 179.542 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.88 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 7.5 m0 -60.83 -42.88 98.6 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.777 179.706 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.418 ' HA ' HD13 ' A' ' 74' ' ' LEU . 4.6 ttp -68.17 -43.53 78.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.299 -178.44 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -72.42 -34.05 67.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.896 0.379 . . . . 0.0 110.054 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.517 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.03 -43.81 97.67 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.116 179.441 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -69.09 -45.72 69.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.334 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.691 HD11 ' HB3' ' A' ' 71' ' ' ARG . 2.0 mm -55.25 -55.7 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.364 -179.273 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.459 ' HA ' ' HD2' ' A' ' 53' ' ' ARG . 20.8 m-80 -65.5 -36.28 83.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.145 0.498 . . . . 0.0 110.731 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.527 ' CD1' ' HG3' ' A' ' 55' ' ' GLN . 0.7 OUTLIER -62.19 -45.61 92.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.517 -179.497 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.546 ' CD2' HD13 ' A' ' 70' ' ' LEU . 17.3 m-85 -76.01 -33.46 59.68 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -178.731 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 49' ' ' ILE . 0.8 OUTLIER -63.53 -24.99 68.05 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 119.849 -0.741 . . . . 0.0 110.755 -179.697 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -98.79 -16.01 19.07 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.527 ' HG3' ' CD1' ' A' ' 51' ' ' TYR . 7.0 mm-40 -102.09 45.85 0.95 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.609 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.563 ' HB ' ' CD ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -125.0 173.54 10.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.173 0.511 . . . . 0.0 111.496 179.353 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.435 ' O ' ' NE ' ' A' ' 63' ' ' ARG . 12.1 p -144.17 171.16 14.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.183 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.49 -155.52 30.97 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.2 -1.0 . . . . 0.0 112.891 179.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.46 ' O ' ' NE ' ' A' ' 63' ' ' ARG . 1.4 mt-10 -67.9 144.76 97.5 Favored Pre-proline 0 C--N 1.333 -0.15 0 CA-C-O 120.755 0.312 . . . . 0.0 111.221 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.473 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 42.3 Cg_endo -67.45 -25.64 41.46 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.784 2.323 . . . . 0.0 113.084 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.56 -43.89 95.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.13 0.49 . . . . 0.0 110.886 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.44 ' HB2' ' NH2' ' A' ' 63' ' ' ARG . 1.8 mt-10 -60.71 -43.36 97.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.045 179.344 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.704 ' O ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -55.26 -51.39 66.79 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.298 0.57 . . . . 0.0 109.605 179.219 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.33 -41.49 72.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.705 -178.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.427 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 0.2 OUTLIER -63.25 -49.78 72.76 Favored 'General case' 0 CA--C 1.523 -0.081 0 C-N-CA 119.941 -0.704 . . . . 0.0 110.328 179.888 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.94 -40.91 90.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.307 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.704 HD13 ' O ' ' A' ' 63' ' ' ARG . 2.4 mp -61.96 -45.89 91.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.459 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' A' ' 71' ' ' ARG . 2.2 pp0? -66.72 -38.23 86.27 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.189 0.519 . . . . 0.0 110.06 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.89 -30.89 71.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.545 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.546 HD13 ' CD2' ' A' ' 52' ' ' TYR . 1.9 mt -71.02 -49.84 40.62 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.141 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.691 ' HB3' HD11 ' A' ' 49' ' ' ILE . 6.7 ptt85 -56.4 -40.26 74.35 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.455 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 1.1 mt-30 -72.9 -35.91 67.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.227 0.537 . . . . 0.0 109.555 178.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -45.48 94.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.093 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 45' ' ' MET . 11.5 mt -67.87 -45.08 75.53 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.121 0.486 . . . . 0.0 110.329 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.7 -38.17 60.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.756 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.402 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 2.6 p -80.86 -50.7 9.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.137 0.494 . . . . 0.0 110.624 179.212 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.408 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 4.4 mt -56.59 -33.01 65.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.148 -179.196 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.19 -31.02 60.83 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.559 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.4 OUTLIER -51.85 -50.23 79.14 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.228 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.559 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 52.5 Cg_endo -69.73 -33.98 15.6 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.522 2.148 . . . . 0.0 113.177 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.821 ' HB2' HD22 ' A' ' 22' ' ' LEU . 2.2 t80 -66.15 -53.56 36.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.982 0.42 . . . . 0.0 110.505 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.8 mt -58.31 -29.02 65.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.796 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.9 -47.94 60.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.87 0.367 . . . . 0.0 110.475 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -41.42 84.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.527 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.54 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.3 OUTLIER -76.19 -33.41 59.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.759 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 mmt-85 -67.11 -40.5 86.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.045 0.45 . . . . 0.0 110.098 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.66 -36.89 68.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.926 179.057 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.567 ' O ' ' HB3' ' A' ' 92' ' ' HIS . 26.4 t80 -72.46 -28.78 63.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.676 179.15 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.553 HD23 ' HG3' ' A' ' 34' ' ' GLU . 2.2 mp -71.95 -45.62 60.41 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.64 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -72.83 -31.16 64.59 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.735 -1.12 . . . . 0.0 112.085 -179.273 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.28 -14.15 20.41 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.777 1.028 . . . . 0.0 113.777 -177.835 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.74 ' CE1' HD13 ' A' ' 31' ' ' LEU . 0.8 OUTLIER -89.7 128.88 36.17 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.566 179.608 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -121.04 142.16 50.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.49 178.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 94' ' ' LEU . 12.2 mt . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.139 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 mtpt . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.639 0.257 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.61 -44.45 82.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.196 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.2 tp -60.04 -45.1 93.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.783 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.538 HG22 HD23 ' A' ' 15' ' ' LEU . 43.6 mm -60.49 -54.23 38.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.878 179.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.8 m -51.92 -33.06 35.49 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.869 0.366 . . . . 0.0 110.697 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.76 -44.42 77.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.241 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.466 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.2 -28.22 72.97 Favored Glycine 0 N--CA 1.451 -0.365 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 177.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.538 HD23 HG22 ' A' ' 11' ' ' ILE . 1.7 mm? -70.08 -61.37 1.8 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.52 -0.84 . . . . 0.0 110.253 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.659 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.8 ttpm? -59.3 -36.07 74.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.985 0.421 . . . . 0.0 110.086 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -60.58 -49.39 77.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.275 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.505 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -71.26 -49.31 44.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.391 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.609 ' HA ' HD12 ' A' ' 22' ' ' LEU . 1.3 m -55.36 -51.55 66.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.966 0.413 . . . . 0.0 110.802 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.659 HG23 ' O ' ' A' ' 16' ' ' LYS . 46.3 t -66.45 -34.95 73.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.065 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.864 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 0.5 OUTLIER -65.88 -46.21 79.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.641 0.258 . . . . 0.0 111.199 -179.741 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.66 HD23 ' CD2' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -64.38 -40.91 96.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.951 0.405 . . . . 0.0 110.358 179.857 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -82.78 -17.25 44.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.149 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.445 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -105.35 6.98 33.13 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.851 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -50.77 162.23 0.28 Allowed 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 177.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.7 p -108.24 133.87 51.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 119.322 0.965 . . . . 0.0 110.868 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.454 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.6 m-85 . . . . . 0 C--N 1.327 -0.378 0 CA-C-O 121.312 0.577 . . . . 0.0 110.937 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.56 HD23 ' CE2' ' A' ' 88' ' ' PHE . 3.6 mp . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 120.9 0.381 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.864 HG22 ' HB3' ' A' ' 36' ' ' ASP . 1.9 p -78.0 146.31 8.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.598 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.1 m -79.76 172.45 13.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.19 0.519 . . . . 0.0 111.809 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.904 ' O ' HG23 ' A' ' 38' ' ' VAL . 3.1 tt0 -64.63 -44.4 90.62 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.841 -178.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -34.49 77.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.185 0.517 . . . . 0.0 110.514 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.873 ' O ' HG23 ' A' ' 40' ' ' VAL . 9.2 t70 -72.22 -38.18 69.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.021 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.889 ' O ' HG23 ' A' ' 41' ' ' VAL . 2.0 tpt -67.81 -43.05 80.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.671 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 34' ' ' GLU . 46.5 t -57.97 -47.27 87.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.479 179.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -59.59 -46.98 87.35 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.858 0.361 . . . . 0.0 110.092 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.873 HG23 ' O ' ' A' ' 36' ' ' ASP . 40.6 t -58.75 -45.06 91.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.515 179.333 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.889 HG23 ' O ' ' A' ' 37' ' ' MET . 40.1 t -61.9 -48.57 87.96 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.383 179.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -58.27 -46.42 86.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.312 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.6 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -57.99 -45.6 86.53 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.076 179.175 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.864 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 10.9 m0 -60.21 -39.54 86.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.217 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.746 ' HG3' HD12 ' A' ' 74' ' ' LEU . 27.4 ttm -71.2 -43.95 66.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.784 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -73.66 -36.45 65.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.984 0.421 . . . . 0.0 110.022 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.6 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.22 -44.59 94.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.053 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -69.77 -43.67 71.7 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.944 0.402 . . . . 0.0 110.459 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.478 ' O ' ' CG ' ' A' ' 53' ' ' ARG . 9.8 mm -54.66 -55.72 14.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.47 ' HA ' ' HG3' ' A' ' 53' ' ' ARG . 11.3 t30 -62.07 -36.63 82.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.337 0.589 . . . . 0.0 110.373 179.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.521 ' HB2' ' O ' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -57.75 -48.53 79.36 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.332 179.72 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.575 ' O ' HG22 ' A' ' 56' ' ' VAL . 23.1 m-85 -75.63 -30.36 59.47 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.48 ' HG2' ' HG ' ' A' ' 67' ' ' LEU . 0.1 OUTLIER -62.77 -28.06 69.72 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.146 179.278 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -97.11 -15.8 20.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.02 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.475 ' HG3' ' CD1' ' A' ' 51' ' ' TYR . 12.2 mm-40 -102.71 45.19 0.97 Allowed 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.678 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -120.83 163.73 18.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.028 0.442 . . . . 0.0 111.144 179.22 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.02 171.6 14.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.565 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 81.19 -156.06 37.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.264 -0.969 . . . . 0.0 113.06 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -68.69 156.96 89.82 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.851 0.358 . . . . 0.0 111.235 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.434 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 43.8 Cg_endo -67.85 -23.34 41.52 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.674 2.249 . . . . 0.0 112.9 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -65.05 -44.07 90.22 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.84 0.352 . . . . 0.0 111.461 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -64.54 -42.77 95.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.079 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.678 ' HA ' HG11 ' A' ' 56' ' ' VAL . 15.8 mtt180 -53.77 -52.34 60.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -57.04 -42.18 80.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.866 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.41 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 0.1 OUTLIER -62.6 -31.86 72.76 Favored 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.55 179.909 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.438 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -72.82 -40.8 65.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.493 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.594 HD13 ' O ' ' A' ' 63' ' ' ARG . 0.6 OUTLIER -70.5 -35.87 73.47 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.556 -179.59 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.423 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 15.5 pt20 -72.82 -47.62 44.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.995 0.426 . . . . 0.0 110.272 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.464 ' O ' ' HB2' ' A' ' 73' ' ' GLU . 12.3 mt-10 -61.96 -36.57 81.84 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.271 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 66' ' ' ALA . 0.2 OUTLIER -64.71 -48.41 74.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.722 0.296 . . . . 0.0 110.253 179.087 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.7 ttt-85 -54.55 -43.45 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -31.78 65.09 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 4.3 tp10 -62.46 -49.48 75.27 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.128 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.746 HD12 ' HG3' ' A' ' 45' ' ' MET . 14.0 mt -67.87 -44.7 76.45 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.053 0.454 . . . . 0.0 110.524 178.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.38 -39.65 61.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.694 -179.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.426 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 27.7 m -80.91 -50.67 9.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.737 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.418 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 1.1 mt -55.8 -33.99 64.9 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.152 -179.185 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.85 -30.93 61.51 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.3 0.481 . . . . 0.0 112.3 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.558 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 4.8 m-20 -51.72 -50.24 78.62 Favored Pre-proline 0 C--N 1.328 -0.326 0 N-CA-C 111.811 0.301 . . . . 0.0 111.811 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.558 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 51.3 Cg_endo -69.65 -36.24 11.47 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.444 2.096 . . . . 0.0 113.092 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.66 ' CD2' HD23 ' A' ' 22' ' ' LEU . 3.4 t80 -62.99 -53.79 48.38 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.044 0.449 . . . . 0.0 110.514 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 59.6 mt -54.96 -31.85 60.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.769 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.81 -44.78 72.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.394 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 80' ' ' PRO . 6.0 mttm -57.39 -43.33 83.55 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.077 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.492 ' OH ' HG12 ' A' ' 32' ' ' VAL . 1.2 t80 -74.14 -33.53 63.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.997 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -45.71 93.65 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.08 -33.0 71.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.623 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.56 ' CE2' HD23 ' A' ' 31' ' ' LEU . 30.5 t80 -67.42 -29.06 68.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.173 179.066 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.5 HD13 ' HA ' ' A' ' 89' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.613 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.703 ' HA ' HD12 ' A' ' 11' ' ' ILE . 5.3 tttp . . . . . 0 N--CA 1.456 -0.139 0 CA-C-O 120.642 0.258 . . . . 0.0 111.086 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.88 -44.51 92.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.836 0.35 . . . . 0.0 110.268 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.731 HD11 ' HG3' ' A' ' 55' ' ' GLN . 4.3 tp -61.01 -45.79 93.36 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.144 0.497 . . . . 0.0 109.837 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.703 HD12 ' HA ' ' A' ' 8' ' ' LYS . 11.9 mt -60.39 -53.68 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.013 179.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.2 p -54.31 -33.05 57.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.64 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.89 -41.45 82.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.75 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.498 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -70.24 -42.48 66.24 Favored Glycine 0 C--O 1.227 -0.316 0 N-CA-C 109.113 -1.595 . . . . 0.0 109.113 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.493 HD23 HG22 ' A' ' 11' ' ' ILE . 1.7 mm? -54.41 -58.27 8.08 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 113.822 -1.189 . . . . 0.0 109.221 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.461 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -60.38 -29.43 68.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.503 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.461 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -68.82 -46.44 68.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.437 179.616 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.579 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -71.83 -46.43 58.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.821 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 79.0 p -55.43 -51.52 66.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.02 0.438 . . . . 0.0 110.366 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.426 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 77.5 t -67.16 -31.11 51.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.564 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.898 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 18.0 tp -64.27 -46.38 83.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.895 0.379 . . . . 0.0 110.237 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.784 HD22 ' HB2' ' A' ' 81' ' ' PHE . 9.4 mt -66.26 -36.61 83.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.256 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.61 -17.41 44.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.386 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.426 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 0.4 OUTLIER -111.81 6.46 19.67 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -179.066 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.522 HE22 HD23 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -48.56 162.59 0.09 Allowed 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 177.594 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 23.5 t -110.66 134.33 53.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 119.592 1.087 . . . . 0.0 110.23 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.42 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 13.4 m-85 . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 121.652 0.739 . . . . 0.0 110.916 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.499 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.4 mp . . . . . 0 C--O 1.231 0.082 0 CA-C-O 121.193 0.52 . . . . 0.0 111.967 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.437 HG12 ' OH ' ' A' ' 85' ' ' TYR . 9.9 p -77.69 155.98 5.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.729 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.416 ' N ' HG22 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -79.85 171.7 14.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.124 0.488 . . . . 0.0 111.725 -178.612 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.93 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -71.05 -31.68 68.19 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.648 -179.271 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -67.07 -37.01 83.25 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.238 0.542 . . . . 0.0 110.182 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.901 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.4 OUTLIER -72.65 -34.71 67.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.465 178.686 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.723 ' O ' HG23 ' A' ' 41' ' ' VAL . 2.6 tpt -67.78 -46.1 72.98 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.45 178.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.93 HG23 ' O ' ' A' ' 34' ' ' GLU . 59.8 t -55.83 -47.99 78.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.303 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.401 HG22 ' O ' ' A' ' 36' ' ' ASP . 0.5 OUTLIER -58.06 -46.72 84.95 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.896 0.379 . . . . 0.0 110.027 179.362 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.901 HG23 ' O ' ' A' ' 36' ' ' ASP . 46.8 t -57.22 -47.5 84.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.577 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.723 HG23 ' O ' ' A' ' 37' ' ' MET . 32.8 t -61.37 -47.97 91.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.554 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -56.36 -48.53 76.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.505 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.591 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 1.8 m-20 -60.04 -45.07 94.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.681 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.898 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 13.1 m0 -60.72 -42.48 97.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.087 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 39.8 mtm -66.63 -48.74 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -178.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -70.48 -32.84 70.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.977 0.418 . . . . 0.0 110.063 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.591 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -62.75 -42.6 99.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.043 179.338 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.472 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 6.3 m-85 -69.82 -44.81 69.22 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.335 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.458 HD12 ' HA ' ' A' ' 49' ' ' ILE . 0.3 OUTLIER -57.34 -55.29 21.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.937 0.399 . . . . 0.0 110.758 -179.874 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -66.4 -41.19 89.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.906 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.492 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 5.0 t80 -60.43 -46.0 91.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.367 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.569 ' O ' HG22 ' A' ' 56' ' ' VAL . 25.9 m-85 -70.19 -31.29 68.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.738 -0.664 . . . . 0.0 112.184 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.911 ' HB2' HD21 ' A' ' 67' ' ' LEU . 34.5 ttm-85 -59.12 -27.96 66.09 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.684 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -94.99 -17.93 21.51 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.731 ' HG3' HD11 ' A' ' 10' ' ' LEU . 5.5 pt20 -105.54 45.13 0.98 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -124.1 163.5 23.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.525 178.792 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.4 m -127.07 166.45 17.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.441 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 91.6 -149.79 19.99 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.715 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -80.63 157.02 72.73 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.804 0.335 . . . . 0.0 111.005 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.435 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 42.6 Cg_endo -67.72 -19.75 47.11 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.874 2.383 . . . . 0.0 113.479 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -66.2 -43.98 85.21 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.891 0.376 . . . . 0.0 111.446 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -66.7 -35.43 80.11 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.181 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.532 ' HG3' ' HB ' ' A' ' 56' ' ' VAL . 2.2 mpt_? -59.48 -50.96 71.91 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -58.44 -41.64 85.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.548 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -49.67 73.9 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.262 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.486 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.13 -33.76 67.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.269 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.911 HD21 ' HB2' ' A' ' 53' ' ' ARG . 4.2 mp -69.68 -34.28 73.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.279 179.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.539 ' HA ' ' HG2' ' A' ' 71' ' ' ARG . 0.8 OUTLIER -74.43 -48.75 25.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.559 179.506 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.443 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 7.2 mm-40 -63.28 -30.34 71.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.875 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.501 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 1.4 tp -73.65 -48.4 32.65 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.686 -0.406 . . . . 0.0 109.945 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.539 ' HG2' ' HA ' ' A' ' 68' ' ' GLN . 6.7 ptp180 -56.88 -38.48 72.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.441 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.514 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 3.1 pt20 -75.03 -36.0 61.9 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.287 0.565 . . . . 0.0 109.51 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.473 ' OE2' HD11 ' A' ' 15' ' ' LEU . 4.1 mm-40 -62.63 -42.17 99.43 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.397 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.574 HD23 ' CD2' ' A' ' 18' ' ' PHE . 37.6 mt -67.86 -45.21 75.22 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.126 0.489 . . . . 0.0 110.009 178.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -53.78 -38.65 64.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.137 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.7 -34.53 34.54 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.059 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.426 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 3.4 mt -74.5 -28.15 60.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.046 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.08 -29.82 60.77 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.569 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.1 m120 -54.69 -50.19 87.12 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 45.1 Cg_endo -68.74 -37.04 12.75 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.403 2.069 . . . . 0.0 112.81 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.784 ' HB2' HD22 ' A' ' 22' ' ' LEU . 1.5 t80 -63.94 -52.61 58.96 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.087 0.47 . . . . 0.0 110.254 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 60.0 mt -57.04 -28.13 62.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.721 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.97 -46.73 61.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.905 0.383 . . . . 0.0 110.369 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.9 mmmt -57.09 -43.09 81.86 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.296 179.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.518 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.3 OUTLIER -76.05 -33.32 59.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.62 179.551 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 40.8 mtt180 -64.87 -42.37 94.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.065 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.59 -34.32 67.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.268 0.556 . . . . 0.0 109.73 178.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.499 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 6.9 t80 -71.04 -28.71 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.627 179.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.679 HD23 ' HG3' ' A' ' 34' ' ' GLU . 4.2 mp . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.083 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.877 ' HA ' HD12 ' A' ' 11' ' ' ILE . 1.6 pttm . . . . . 0 N--CA 1.456 -0.162 0 CA-C-O 120.705 0.288 . . . . 0.0 110.736 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.94 -44.57 89.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.343 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.486 HD22 ' O ' ' A' ' 55' ' ' GLN . 1.7 tp -61.99 -43.79 98.1 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.877 HD12 ' HA ' ' A' ' 8' ' ' LYS . 7.6 mt -61.35 -54.36 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.504 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -55.45 -43.05 75.07 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.424 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.488 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -58.86 -43.36 90.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.851 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.687 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.83 -28.32 72.11 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 177.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.504 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.3 OUTLIER -65.41 -61.33 2.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.095 -1.053 . . . . 0.0 110.322 179.053 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.637 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.1 mtpt -58.0 -38.46 76.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.203 0.525 . . . . 0.0 109.932 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.6 tt0 -56.57 -49.57 74.46 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.279 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.665 ' CE2' HD23 ' A' ' 74' ' ' LEU . 0.7 OUTLIER -71.41 -50.58 30.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.553 -179.481 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -51.75 67.0 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.05 0.452 . . . . 0.0 110.776 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.637 HG23 ' O ' ' A' ' 16' ' ' LYS . 48.9 t -64.19 -35.64 74.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.625 179.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.928 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 0.3 OUTLIER -66.27 -45.87 79.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.688 0.28 . . . . 0.0 110.911 -179.855 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.738 HD22 ' CG ' ' A' ' 81' ' ' PHE . 11.1 mt -60.43 -40.26 90.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.885 0.374 . . . . 0.0 110.309 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.57 -21.93 35.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.938 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.479 ' HG3' ' HA ' ' A' ' 21' ' ' LEU . 0.4 OUTLIER -108.91 21.53 17.11 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.753 -179.432 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.664 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -71.07 33.24 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -179.296 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.664 ' O ' ' O ' ' A' ' 25' ' ' GLN . 21.9 t 24.86 120.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 179.045 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 . . . . . 0 C--N 1.329 -0.301 0 CA-C-O 121.023 0.439 . . . . 0.0 110.573 178.678 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' A' ' 31' ' ' LEU . 4.2 mt . . . . . 0 N--CA 1.456 -0.145 0 CA-C-O 121.021 0.439 . . . . 0.0 111.317 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.583 HG22 ' HB3' ' A' ' 36' ' ' ASP . 15.0 p -79.94 150.25 5.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.386 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.3 m -79.65 172.92 13.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.153 0.501 . . . . 0.0 111.632 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.959 ' O ' HG23 ' A' ' 38' ' ' VAL . 1.2 tm-20 -67.52 -42.62 82.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.904 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -67.92 -37.79 82.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.19 0.519 . . . . 0.0 110.599 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.829 ' O ' HG23 ' A' ' 40' ' ' VAL . 9.0 t0 -67.96 -37.76 81.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.353 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.547 ' O ' HG23 ' A' ' 41' ' ' VAL . 6.4 tpt -68.43 -39.9 81.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.733 178.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.959 HG23 ' O ' ' A' ' 34' ' ' GLU . 92.6 t -56.77 -45.71 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.682 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -46.21 91.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.937 178.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.829 HG23 ' O ' ' A' ' 36' ' ' ASP . 37.0 t -55.46 -48.34 77.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.791 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 37' ' ' MET . 22.7 t -67.87 -41.35 84.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.925 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -43.68 79.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.105 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.584 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 2.8 p30 -71.54 -38.62 71.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.246 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.928 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 6.6 m0 -60.98 -41.34 96.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.019 0.438 . . . . 0.0 110.474 178.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.758 ' HG2' HD22 ' A' ' 74' ' ' LEU . 47.8 mtm -71.01 -40.81 71.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.783 -179.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -73.39 -35.21 65.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.028 0.442 . . . . 0.0 110.138 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.584 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -65.44 -42.0 92.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.207 179.603 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.442 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 4.5 m-85 -69.2 -44.39 72.24 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.738 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.577 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -54.39 -54.33 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.321 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.556 ' HA ' ' HG3' ' A' ' 53' ' ' ARG . 20.6 t30 -61.64 -36.75 81.7 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 121.367 0.603 . . . . 0.0 109.886 178.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.451 ' HB2' ' O ' ' A' ' 47' ' ' PHE . 1.1 t80 -59.04 -43.98 91.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.91 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.687 ' OH ' ' HA3' ' A' ' 14' ' ' GLY . 30.2 m-85 -75.36 -30.67 60.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.641 ' HA ' HD11 ' A' ' 67' ' ' LEU . 15.5 mtp85 -60.85 -31.26 70.71 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.63 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -93.36 -13.08 28.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.396 -178.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.486 ' O ' HD22 ' A' ' 10' ' ' LEU . 4.6 mm-40 -107.15 39.99 1.76 Allowed 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.767 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -118.06 153.69 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.298 178.555 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.44 171.54 9.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.365 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.97 -152.93 25.13 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.954 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.401 ' O ' ' HG3' ' A' ' 63' ' ' ARG . 7.7 mt-10 -73.66 161.34 79.24 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-O 120.727 0.299 . . . . 0.0 110.991 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.426 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 42.7 Cg_endo -67.76 -25.1 40.04 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.53 2.153 . . . . 0.0 112.671 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -43.87 81.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.858 0.361 . . . . 0.0 111.138 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -66.65 -44.38 82.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.408 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.767 ' HA ' HG11 ' A' ' 56' ' ' VAL . 11.4 mtt85 -53.65 -51.45 63.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.14 -41.73 84.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.969 -179.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.471 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 8.5 tttp -64.22 -31.12 72.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.946 0.403 . . . . 0.0 110.86 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.756 ' O ' HD23 ' A' ' 70' ' ' LEU . . . -73.85 -34.76 64.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.984 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.641 HD11 ' HA ' ' A' ' 53' ' ' ARG . 3.6 mp -71.71 -36.56 70.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.361 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 6.4 pt20 -71.81 -46.49 58.01 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.417 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.0 OUTLIER -62.78 -33.82 75.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.931 178.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.756 HD23 ' O ' ' A' ' 66' ' ' ALA . 1.5 mm? -64.3 -49.33 72.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.774 179.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.9 tpp85 -55.34 -47.43 75.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.653 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.15 -36.28 79.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.324 0.583 . . . . 0.0 109.658 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -60.96 -42.54 98.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.723 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.758 HD22 ' HG2' ' A' ' 45' ' ' MET . 6.3 mt -67.74 -45.1 75.96 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.215 0.531 . . . . 0.0 109.954 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -52.53 -38.92 60.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.944 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.407 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 3.0 m -80.78 -50.61 9.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.79 -37.76 66.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.057 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.36 -27.84 59.31 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.561 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.7 t-20 -51.62 -50.02 79.55 Favored Pre-proline 0 CA--C 1.533 0.289 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.561 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.6 Cg_endo -69.09 -32.61 20.98 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.304 2.002 . . . . 0.0 113.082 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.738 ' CG ' HD22 ' A' ' 22' ' ' LEU . 10.6 t80 -64.66 -53.72 42.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.913 0.387 . . . . 0.0 110.905 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.3 mt -54.89 -37.82 66.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.185 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.36 -45.65 83.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.803 0.335 . . . . 0.0 110.591 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -58.17 -40.74 82.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.775 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.492 ' HE2' HG13 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -73.82 -33.62 64.23 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.752 179.849 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -43.45 98.81 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -72.68 -31.42 65.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.055 178.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -72.46 -29.08 63.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.905 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 85' ' ' TYR . 3.0 mm? . . . . . 0 C--N 1.33 -0.28 0 CA-C-O 121.257 0.551 . . . . 0.0 110.067 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.6 mmtp . . . . . 0 N--CA 1.456 -0.136 0 CA-C-O 120.769 0.318 . . . . 0.0 110.636 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.69 -45.12 68.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.499 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.467 HD12 ' CD1' ' A' ' 52' ' ' TYR . 0.0 OUTLIER -61.2 -43.65 98.54 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.149 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.779 HD11 ' HB1' ' A' ' 66' ' ' ALA . 41.8 mm -64.0 -54.6 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.917 179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.449 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 35.9 m -57.91 -33.24 68.55 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.745 0.307 . . . . 0.0 110.947 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.45 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -66.12 -42.92 88.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.674 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.488 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -71.14 -38.42 63.44 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 177.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.6 mm? -54.68 -59.96 4.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.018 -1.091 . . . . 0.0 109.447 178.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.607 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.1 OUTLIER -59.43 -33.55 71.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.027 0.441 . . . . 0.0 110.041 179.41 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.0 tp10 -61.27 -49.16 78.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.637 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.599 ' CE2' HD23 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -72.32 -49.09 37.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.845 -179.723 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 87.9 p -55.31 -43.57 75.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.939 0.4 . . . . 0.0 110.381 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 16' ' ' LYS . 87.6 t -74.36 -27.36 21.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.436 179.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.908 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 21.6 tp -68.9 -46.17 69.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.892 0.377 . . . . 0.0 110.305 179.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.977 HD22 ' CD2' ' A' ' 81' ' ' PHE . 9.3 mt -71.94 -35.14 69.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.433 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -82.71 -23.69 33.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.565 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.451 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -109.8 10.62 24.58 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.415 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.4 162.41 0.15 Allowed 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.2 t -110.3 134.98 50.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 119.645 1.111 . . . . 0.0 110.671 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 5.9 m-85 . . . . . 0 C--N 1.325 -0.492 0 CA-C-O 121.784 0.802 . . . . 0.0 110.937 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.524 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.2 mp . . . . . 0 C--O 1.23 0.063 0 CA-C-O 121.153 0.501 . . . . 0.0 112.127 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.464 HG22 ' HB2' ' A' ' 36' ' ' ASP . 13.7 p -77.14 153.63 5.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.816 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.85 173.06 12.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.113 0.482 . . . . 0.0 111.636 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.904 ' O ' HG23 ' A' ' 38' ' ' VAL . 2.6 mt-10 -67.75 -39.16 84.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.165 -178.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -68.09 -37.36 81.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.136 0.493 . . . . 0.0 110.701 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.861 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.1 m-20 -70.5 -37.61 74.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.753 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.691 ' O ' HG23 ' A' ' 41' ' ' VAL . 16.2 tpp -66.99 -42.4 85.12 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.561 178.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 34' ' ' GLU . 99.1 t -56.85 -47.94 82.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.197 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -47.52 83.62 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.176 179.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.861 HG23 ' O ' ' A' ' 36' ' ' ASP . 39.1 t -55.7 -43.6 74.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.752 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.691 HG23 ' O ' ' A' ' 37' ' ' MET . 45.6 t -64.96 -45.47 94.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.712 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.46 -49.07 77.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.479 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -58.1 -43.26 87.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.882 179.306 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.908 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 5.3 m0 -60.64 -41.37 94.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.076 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.718 ' HG3' HD13 ' A' ' 74' ' ' LEU . 22.9 ttm -62.48 -50.57 70.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.053 -179.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -69.21 -35.47 76.25 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.472 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.37 -39.37 83.09 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.627 179.158 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.449 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 10.7 m-85 -72.24 -45.74 58.93 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.311 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 10.2 mm -54.07 -55.18 15.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.374 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -70.06 -35.99 74.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.906 0.384 . . . . 0.0 111.169 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.496 ' CE1' ' NE2' ' A' ' 55' ' ' GLN . 2.2 t80 -63.07 -45.8 90.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.502 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.491 ' O ' ' CG2' ' A' ' 56' ' ' VAL . 36.0 m-85 -75.5 -33.1 60.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.857 ' HB2' HD21 ' A' ' 67' ' ' LEU . 12.3 ttp85 -58.56 -30.98 67.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.818 0.342 . . . . 0.0 110.578 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -95.35 -11.07 28.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.889 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.496 ' NE2' ' CE1' ' A' ' 51' ' ' TYR . 1.4 mt-30 -99.86 -5.67 28.07 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -178.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.874 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.8 OUTLIER -73.15 154.01 7.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.711 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 18.7 p -120.87 171.16 8.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.476 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.56 -147.64 23.25 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.69 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.21 164.83 54.42 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.341 . . . . 0.0 110.862 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.405 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 42.6 Cg_endo -67.62 -22.53 44.01 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.616 2.211 . . . . 0.0 112.76 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.407 ' HA ' ' OD2' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -67.29 -44.02 80.31 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.149 0.5 . . . . 0.0 110.778 -179.934 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.6 -41.53 99.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.008 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.874 ' HA ' HG11 ' A' ' 56' ' ' VAL . 12.0 mtt180 -56.9 -51.17 70.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.009 179.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.407 ' OD2' ' HA ' ' A' ' 61' ' ' GLN . 0.3 OUTLIER -57.05 -41.71 79.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.433 -179.118 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.48 -49.73 76.37 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.461 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.779 ' HB1' HD11 ' A' ' 11' ' ' ILE . . . -56.9 -33.37 66.85 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.055 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.857 HD21 ' HB2' ' A' ' 53' ' ' ARG . 5.4 mp -71.18 -33.27 69.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.607 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -72.17 -49.04 38.82 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -62.24 -30.72 71.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.195 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.465 HD11 ' CE2' ' A' ' 52' ' ' TYR . 0.4 OUTLIER -67.39 -49.14 65.13 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.068 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.37 -48.32 74.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.783 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -72.11 -31.73 66.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.99 0.424 . . . . 0.0 110.071 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.429 ' OE2' HD11 ' A' ' 15' ' ' LEU . 3.5 mm-40 -61.64 -48.3 81.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.865 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.718 HD13 ' HG3' ' A' ' 45' ' ' MET . 9.2 mt -67.7 -44.68 77.15 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.048 0.451 . . . . 0.0 110.617 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.3 m-20 -52.8 -42.06 64.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.462 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.4 t -80.65 -34.19 35.09 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.436 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.479 HD13 ' HD2' ' A' ' 18' ' ' PHE . 2.8 mt -73.5 -30.22 62.99 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.11 -29.89 60.7 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -179.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.562 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 11.7 m-20 -57.33 -50.2 89.53 Favored Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 111.558 0.207 . . . . 0.0 111.558 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.562 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 44.9 Cg_endo -69.8 -37.59 8.86 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.36 2.04 . . . . 0.0 112.649 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.977 ' CD2' HD22 ' A' ' 22' ' ' LEU . 1.5 t80 -64.76 -52.57 56.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.055 0.455 . . . . 0.0 110.678 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.415 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 28.5 mt -57.1 -30.02 64.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.576 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.81 -48.04 64.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.558 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.83 -41.78 78.45 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.949 0.404 . . . . 0.0 110.266 179.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.653 ' CD2' ' HE2' ' A' ' 37' ' ' MET . 0.2 OUTLIER -74.65 -33.2 62.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.294 179.391 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.415 ' HB3' ' O ' ' A' ' 82' ' ' LEU . 0.0 OUTLIER -63.37 -42.45 98.87 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.64 -32.88 66.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.946 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.524 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 9.3 t80 -72.59 -28.78 63.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.049 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.518 HD23 ' O ' ' A' ' 85' ' ' TYR . 2.2 mm? . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.018 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.638 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.455 -0.192 0 CA-C-O 120.768 0.318 . . . . 0.0 110.603 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -67.26 -45.35 76.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.437 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.833 HD21 ' HG3' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -62.72 -42.19 99.53 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.506 -0.554 . . . . 0.0 109.506 178.73 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.638 HD12 ' HA ' ' A' ' 8' ' ' LYS . 25.4 mt -62.35 -54.06 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.037 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.2 t -57.47 -33.24 67.76 Favored 'General case' 0 C--N 1.333 -0.144 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 -179.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.12 -42.63 75.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.782 0.325 . . . . 0.0 110.861 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.61 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.91 -40.06 74.58 Favored Glycine 0 C--O 1.225 -0.459 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 177.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.902 HD21 ' HG2' ' A' ' 73' ' ' GLU . 1.7 mm? -54.81 -59.17 5.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.592 -1.304 . . . . 0.0 109.448 178.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.413 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -60.23 -30.93 69.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.543 179.685 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 0.6 OUTLIER -67.69 -46.36 72.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.241 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.599 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -69.74 -49.36 53.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.718 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 74.6 p -55.4 -50.44 69.75 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.133 0.492 . . . . 0.0 110.151 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.452 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 47.2 t -62.56 -34.55 65.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.271 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.966 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 12.2 tp -62.56 -46.22 89.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.469 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.997 HD13 ' HB2' ' A' ' 81' ' ' PHE . 6.0 mt -63.91 -37.24 86.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.095 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.69 -17.44 44.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.824 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 5.2 mt-30 -106.99 -3.4 20.14 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -46.9 160.09 0.09 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 19.7 t -104.69 128.41 58.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 118.81 0.732 . . . . 0.0 111.73 -179.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.838 179.258 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.513 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 0.7 OUTLIER . . . . . 0 N--CA 1.461 0.098 0 CA-C-O 121.364 0.602 . . . . 0.0 111.94 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.447 HG21 ' HB3' ' A' ' 36' ' ' ASP . 11.4 p -77.1 157.54 5.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.04 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.445 ' N ' HG22 ' A' ' 32' ' ' VAL . 3.0 p -79.51 171.01 15.74 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.263 0.554 . . . . 0.0 111.909 -178.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.893 ' O ' HG23 ' A' ' 38' ' ' VAL . 1.5 mt-10 -68.76 -34.45 75.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.112 -178.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -34.73 78.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.9 0.381 . . . . 0.0 110.716 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.886 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.3 OUTLIER -71.8 -42.15 67.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.115 179.454 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.671 ' O ' HG23 ' A' ' 41' ' ' VAL . 12.5 tpp -65.15 -43.43 91.83 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 34' ' ' GLU . 93.9 t -55.89 -48.0 79.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.305 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -46.62 88.23 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.864 0.364 . . . . 0.0 110.364 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.886 HG23 ' O ' ' A' ' 36' ' ' ASP . 23.7 t -56.75 -45.47 82.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.835 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.671 HG23 ' O ' ' A' ' 37' ' ' MET . 39.5 t -66.73 -44.98 89.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.789 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -51.16 71.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.415 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.2 OUTLIER -60.05 -43.48 95.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.156 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.966 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 7.9 m0 -60.78 -41.06 94.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.337 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.9 ttp -68.0 -43.98 77.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.327 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -70.87 -39.81 72.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.941 0.401 . . . . 0.0 110.014 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.445 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -59.38 -41.5 89.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.574 179.091 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.453 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 3.9 m-85 -65.01 -48.09 75.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.775 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.858 HD11 ' HB2' ' A' ' 71' ' ' ARG . 0.7 OUTLIER -54.2 -55.0 16.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.082 -179.395 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.457 ' N ' HG22 ' A' ' 49' ' ' ILE . 70.9 m-80 -68.97 -36.74 78.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.806 0.336 . . . . 0.0 111.085 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.445 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 7.0 t80 -63.07 -42.04 99.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.126 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.645 ' O ' HG22 ' A' ' 56' ' ' VAL . 27.8 m-85 -75.47 -33.68 60.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.54 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.674 ' HA ' HD11 ' A' ' 67' ' ' LEU . 2.8 ttm-85 -58.37 -31.59 67.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.12 0.486 . . . . 0.0 110.581 179.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -101.03 -9.81 21.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.196 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.833 ' HG3' HD21 ' A' ' 10' ' ' LEU . 12.4 tp-100 -97.54 -3.29 40.04 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.662 ' HB ' ' CG ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -78.81 173.58 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.469 179.564 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.457 HG22 ' H ' ' A' ' 58' ' ' GLY . 5.0 m -139.79 171.09 14.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.034 179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.457 ' H ' HG22 ' A' ' 57' ' ' THR . . . 88.15 -150.4 22.07 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.171 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.411 ' O ' ' HD2' ' A' ' 63' ' ' ARG . 0.4 OUTLIER -77.9 162.95 65.67 Favored Pre-proline 0 C--N 1.334 -0.103 0 CA-C-O 120.829 0.347 . . . . 0.0 111.286 -179.693 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.431 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 40.2 Cg_endo -67.26 -26.62 41.71 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.914 2.409 . . . . 0.0 113.319 -179.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -70.82 -44.18 67.05 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.067 0.461 . . . . 0.0 110.891 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -67.38 -38.25 84.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.959 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.662 ' CG ' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -57.64 -51.3 70.07 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.39 0.614 . . . . 0.0 109.427 178.896 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -58.06 -41.64 83.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.649 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 9.5 tttt -61.59 -49.69 75.62 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.474 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.1 -33.66 67.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.22 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.674 HD11 ' HA ' ' A' ' 53' ' ' ARG . 5.5 mp -69.99 -36.55 75.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.32 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 1.9 pp0? -72.89 -44.74 60.92 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.218 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -63.03 -38.59 91.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.351 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.447 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -63.39 -49.11 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.792 179.521 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.858 ' HB2' HD11 ' A' ' 49' ' ' ILE . 2.7 tpt180 -55.19 -44.85 75.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.523 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.26 -34.52 76.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.24 0.543 . . . . 0.0 109.846 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.902 ' HG2' HD21 ' A' ' 15' ' ' LEU . 1.2 tp10 -60.88 -45.3 95.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.068 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.9 mt -67.61 -45.08 76.46 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.972 0.415 . . . . 0.0 110.366 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -39.8 63.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.011 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.464 HG22 ' O ' ' A' ' 73' ' ' GLU . 10.3 t -80.55 -36.15 33.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.041 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.448 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 2.4 mt -71.24 -29.88 65.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.898 -179.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.84 -30.08 63.73 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.566 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.5 t30 -57.73 -50.09 90.06 Favored Pre-proline 0 CA--C 1.532 0.28 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.566 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 40.5 Cg_endo -67.69 -42.01 7.44 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.278 1.985 . . . . 0.0 112.828 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.997 ' HB2' HD13 ' A' ' 22' ' ' LEU . 1.8 t80 -63.76 -52.59 59.72 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.155 0.502 . . . . 0.0 110.036 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.403 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 24.1 mt -56.59 -29.28 61.9 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.429 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.445 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.03 -48.33 63.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.847 0.356 . . . . 0.0 110.519 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.2 mmtm -57.17 -40.78 77.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.551 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.46 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -77.61 -33.15 53.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.721 -179.544 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.445 ' HG2' ' HA ' ' A' ' 83' ' ' ALA . 1.0 OUTLIER -68.33 -40.52 81.57 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.016 179.409 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.59 -37.21 68.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.862 179.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.513 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 9.1 t80 -71.92 -29.22 64.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.14 178.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.746 HD23 ' HG2' ' A' ' 34' ' ' GLU . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.422 178.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 120.678 0.275 . . . . 0.0 110.852 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -62.32 -44.12 97.23 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.443 . . . . 0.0 109.831 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.44 ' HA ' HD22 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -60.63 -43.32 97.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.716 178.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.808 HD11 ' HB1' ' A' ' 66' ' ' ALA . 40.5 mm -62.04 -54.58 32.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.01 -32.91 22.77 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.668 0.271 . . . . 0.0 111.222 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.13 -42.06 69.7 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.596 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.554 ' N ' ' OH ' ' A' ' 52' ' ' TYR . . . -71.07 -28.42 70.39 Favored Glycine 0 C--O 1.231 -0.085 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 177.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.594 HD23 HG22 ' A' ' 11' ' ' ILE . 1.7 mm? -70.52 -61.17 1.87 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.511 -0.845 . . . . 0.0 109.092 178.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.619 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -57.21 -30.9 64.94 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.896 -179.954 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.419 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 1.5 mm-40 -68.24 -46.09 71.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.413 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.574 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -73.82 -47.38 39.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.351 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.52 -51.42 67.07 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.953 0.406 . . . . 0.0 110.484 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 16' ' ' LYS . 58.0 t -66.41 -36.77 78.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.642 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.992 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 0.8 OUTLIER -59.52 -46.18 89.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.76 0.314 . . . . 0.0 111.137 -179.818 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.918 HD13 ' HB2' ' A' ' 81' ' ' PHE . 15.0 mt -70.51 -34.92 72.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.987 0.422 . . . . 0.0 110.396 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -82.7 -18.43 40.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.154 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.489 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 2.1 mp0 -117.44 12.37 14.18 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -51.58 162.92 0.33 Allowed 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 177.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 24.2 t -112.57 136.41 48.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 119.854 1.206 . . . . 0.0 110.876 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.478 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.2 m-85 . . . . . 0 C--N 1.326 -0.442 0 CA-C-O 121.776 0.798 . . . . 0.0 110.545 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.461 HD22 ' CE2' ' A' ' 88' ' ' PHE . 7.6 mt . . . . . 0 N--CA 1.455 -0.18 0 CA-C-O 120.913 0.387 . . . . 0.0 111.058 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.545 HG22 ' HB3' ' A' ' 36' ' ' ASP . 14.9 p -74.83 143.91 12.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.829 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.7 p -79.97 172.79 13.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.957 0.408 . . . . 0.0 111.537 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.899 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -71.07 -29.66 65.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.423 -179.515 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.44 -38.27 81.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.223 0.535 . . . . 0.0 110.267 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.888 ' O ' HG23 ' A' ' 40' ' ' VAL . 4.9 t70 -71.83 -36.92 70.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.501 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.743 ' O ' HG23 ' A' ' 41' ' ' VAL . 1.8 tpt -67.05 -45.71 76.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.482 178.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.899 HG23 ' O ' ' A' ' 34' ' ' GLU . 89.7 t -55.78 -46.54 79.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.302 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -46.3 88.94 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.847 0.356 . . . . 0.0 110.16 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.888 HG23 ' O ' ' A' ' 36' ' ' ASP . 35.0 t -58.41 -44.05 87.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.696 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.743 HG23 ' O ' ' A' ' 37' ' ' MET . 24.9 t -65.48 -48.47 82.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.611 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.58 -46.52 77.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.464 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.632 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -64.53 -40.89 96.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.542 179.56 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.992 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 5.8 m0 -60.83 -43.99 97.53 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.948 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.7 mtm -66.96 -48.91 67.1 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.781 -178.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -71.13 -28.1 64.04 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.632 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.76 -48.13 82.07 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.125 179.262 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -71.69 -38.48 70.59 Favored 'General case' 0 C--O 1.227 -0.09 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.114 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.687 HD11 ' HB2' ' A' ' 71' ' ' ARG . 10.8 mm -57.41 -55.34 21.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.799 0.333 . . . . 0.0 111.274 -179.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -67.33 -39.71 85.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.186 0.517 . . . . 0.0 110.386 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.499 ' HB3' ' O ' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -61.07 -38.2 85.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.485 179.599 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.554 ' OH ' ' N ' ' A' ' 14' ' ' GLY . 3.2 m-85 -76.1 -36.74 58.79 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -178.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.832 ' HA ' HD11 ' A' ' 67' ' ' LEU . 6.6 ttm180 -59.96 -26.53 66.07 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.419 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 54' ' ' GLN . 6.9 tt0 -93.79 -13.51 27.26 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.492 ' HG3' ' CE1' ' A' ' 51' ' ' TYR . 18.7 mm-40 -103.09 1.94 34.03 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -178.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.538 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -85.85 168.96 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.288 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.1 p -142.58 171.34 14.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.837 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 87.39 -153.54 25.31 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.373 -0.918 . . . . 0.0 112.774 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.5 144.34 86.31 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-O 120.683 0.277 . . . . 0.0 110.891 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.472 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 19.1 Cg_endo -59.12 -24.6 74.47 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.79 2.327 . . . . 0.0 112.725 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.07 -38.32 75.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.938 0.399 . . . . 0.0 110.673 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -68.65 -47.0 67.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.284 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.538 ' HA ' HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -63.51 -50.7 68.58 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.114 0.483 . . . . 0.0 110.066 179.743 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.39 -37.36 67.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.085 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.69 -50.14 59.19 Favored 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.467 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.808 ' HB1' HD11 ' A' ' 11' ' ' ILE . . . -59.57 -35.0 73.43 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.22 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.832 HD11 ' HA ' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -69.44 -40.49 77.17 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.116 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -72.08 -41.62 67.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.079 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.504 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 7.9 mt-10 -66.78 -37.67 85.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.721 HD23 ' HA ' ' A' ' 67' ' ' LEU . 0.4 OUTLIER -67.04 -44.48 80.11 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.282 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.687 ' HB2' HD11 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -55.21 -49.01 73.05 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.828 179.509 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.504 ' HG2' ' HA ' ' A' ' 69' ' ' GLU . 8.4 pt20 -63.31 -31.83 73.09 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.53 ' O ' HG22 ' A' ' 76' ' ' THR . 5.8 tp10 -63.83 -42.45 97.63 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.719 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.494 HD22 ' CD2' ' A' ' 18' ' ' PHE . 5.2 mt -68.02 -45.38 74.18 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 121.134 0.492 . . . . 0.0 110.062 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.76 -37.14 65.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.004 -179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 73' ' ' GLU . 11.0 t -80.86 -32.8 34.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.704 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.419 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 1.5 mt -75.07 -29.64 60.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.895 -179.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.17 -32.1 61.18 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.552 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 3.1 m120 -52.12 -50.2 80.22 Favored Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 49.0 Cg_endo -69.92 -34.98 13.0 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.353 2.036 . . . . 0.0 112.76 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.918 ' HB2' HD13 ' A' ' 22' ' ' LEU . 1.8 t80 -65.31 -53.67 40.49 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.1 mt -58.81 -28.08 65.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.449 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.483 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.71 -41.3 75.55 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.105 0.479 . . . . 0.0 110.376 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -42.52 92.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.587 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.545 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.4 OUTLIER -74.62 -37.92 62.7 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.927 -179.38 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.483 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 12.1 ptm180 -65.32 -37.31 86.73 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.5 -34.91 67.99 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.461 ' CE2' HD22 ' A' ' 31' ' ' LEU . 45.6 t80 -72.05 -28.29 63.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.765 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mm? . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.408 179.142 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.637 ' HA ' HD12 ' A' ' 11' ' ' ILE . 1.6 tttm . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 120.68 0.276 . . . . 0.0 110.988 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -67.78 -40.38 83.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.842 0.353 . . . . 0.0 110.347 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.637 HD11 ' NE2' ' A' ' 55' ' ' GLN . 3.5 tp -65.22 -44.28 88.82 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.637 HD12 ' HA ' ' A' ' 8' ' ' LYS . 16.8 mt -61.95 -54.5 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.523 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 23.1 t -55.61 -39.74 71.16 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.21 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.11 -40.11 80.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.23 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.506 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -70.66 -30.86 68.13 Favored Glycine 0 N--CA 1.451 -0.308 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.523 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.7 mm? -64.9 -61.33 2.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.102 -1.049 . . . . 0.0 110.608 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.623 ' O ' HG23 ' A' ' 20' ' ' VAL . 6.3 mttm -62.17 -36.59 82.33 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -59.72 -50.67 72.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.97 178.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.626 ' CE2' HD13 ' A' ' 74' ' ' LEU . 1.0 OUTLIER -67.26 -50.54 60.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.101 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 t -57.81 -51.63 68.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.874 0.369 . . . . 0.0 111.089 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 16' ' ' LYS . 58.9 t -64.75 -32.57 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.769 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.928 HD11 ' CH2' ' A' ' 44' ' ' TRP . 0.2 OUTLIER -70.36 -46.26 64.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.103 179.73 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.952 HD22 ' CD2' ' A' ' 81' ' ' PHE . 13.8 mt -62.1 -37.58 85.62 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.441 -179.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.63 -38.79 23.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.727 0.298 . . . . 0.0 111.603 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.732 ' O ' ' N ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -106.46 21.31 17.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.776 -179.208 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.488 ' N ' ' O ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -46.27 60.96 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.416 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.732 ' N ' ' O ' ' A' ' 24' ' ' GLN . 11.6 p 27.96 102.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 123.42 0.688 . . . . 0.0 112.517 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.52 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 14.2 m-30 . . . . . 0 C--N 1.329 -0.288 0 CA-C-O 121.515 0.674 . . . . 0.0 111.185 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.489 HD11 ' CE2' ' A' ' 88' ' ' PHE . 7.1 mt . . . . . 0 N--CA 1.455 -0.206 0 CA-C-O 121.013 0.435 . . . . 0.0 111.363 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.505 HG12 ' OH ' ' A' ' 85' ' ' TYR . 7.2 p -76.7 148.59 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.9 m -79.22 169.69 17.75 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.164 0.506 . . . . 0.0 111.535 -177.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.88 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.4 OUTLIER -67.53 -36.61 81.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.03 -179.142 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -36.53 84.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.152 0.501 . . . . 0.0 110.353 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.922 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.6 OUTLIER -74.2 -37.62 63.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.337 178.505 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.873 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.2 OUTLIER -64.35 -47.23 80.14 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.716 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 34' ' ' GLU . 60.2 t -57.61 -45.48 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.803 178.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.0 m -57.96 -47.9 81.55 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.822 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.922 HG23 ' O ' ' A' ' 36' ' ' ASP . 40.8 t -57.65 -40.24 74.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.808 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.873 HG23 ' O ' ' A' ' 37' ' ' MET . 5.1 t -63.02 -48.05 89.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.528 179.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.495 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 0.3 OUTLIER -54.77 -45.58 74.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.735 179.726 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.554 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -72.15 -36.38 69.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.746 179.648 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.928 ' CH2' HD11 ' A' ' 21' ' ' LEU . 1.9 m0 -64.46 -45.33 87.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.321 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.941 ' CB ' HD12 ' A' ' 74' ' ' LEU . 1.9 ptm -71.5 -36.14 71.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.495 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -71.94 -40.81 68.47 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.554 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.5 -46.19 91.04 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.793 179.099 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.474 ' CD1' ' CZ ' ' A' ' 52' ' ' TYR . 3.4 m-85 -60.3 -47.67 85.04 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.644 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.4 mm -54.19 -55.34 14.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.357 -179.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.52 ' HA ' ' HG2' ' A' ' 53' ' ' ARG . 43.9 t30 -69.8 -33.39 72.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.029 0.442 . . . . 0.0 111.171 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.481 ' CZ ' ' NE2' ' A' ' 55' ' ' GLN . 17.0 t80 -68.19 -40.95 82.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.782 -179.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.506 ' OH ' ' HA3' ' A' ' 14' ' ' GLY . 21.9 m-85 -75.68 -36.56 60.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.348 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.756 ' HB3' HD21 ' A' ' 67' ' ' LEU . 7.1 ptp85 -59.88 -24.64 64.43 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.498 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -92.52 -23.64 19.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.519 -179.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.637 ' NE2' HD11 ' A' ' 10' ' ' LEU . 29.0 mt-30 -93.71 34.21 1.22 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.036 0.446 . . . . 0.0 111.666 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.542 HG11 ' HG3' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -112.97 164.76 8.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.093 -179.665 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.6 m -138.45 171.74 13.92 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 81.56 -163.4 44.35 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 119.869 -1.158 . . . . 0.0 112.866 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -64.55 160.55 51.29 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-O 120.872 0.368 . . . . 0.0 111.36 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.427 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 43.7 Cg_endo -67.62 -26.96 39.17 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.92 2.413 . . . . 0.0 112.984 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.415 ' HA ' ' OD2' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -55.62 -41.4 73.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.183 0.516 . . . . 0.0 111.287 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -63.37 -46.66 85.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.029 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.542 ' HG3' HG11 ' A' ' 56' ' ' VAL . 2.3 mpt_? -56.09 -51.63 67.19 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.166 0.508 . . . . 0.0 110.26 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.415 ' OD2' ' HA ' ' A' ' 61' ' ' GLN . 0.1 OUTLIER -55.58 -41.6 73.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.256 -178.901 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -49.72 76.45 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.98 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.2 -36.93 71.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.946 -179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.756 HD21 ' HB3' ' A' ' 53' ' ' ARG . 7.8 mp -70.47 -33.26 71.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.8 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.409 ' CG ' ' O ' ' A' ' 64' ' ' ASP . 1.2 mt-30 -73.55 -48.54 32.17 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.941 0.401 . . . . 0.0 110.192 179.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.27 -33.19 74.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.423 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.538 ' O ' HD23 ' A' ' 74' ' ' LEU . 0.8 OUTLIER -69.39 -48.27 61.64 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.749 -0.38 . . . . 0.0 109.978 179.195 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -55.23 -40.83 71.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.926 0.393 . . . . 0.0 110.392 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.0 -46.41 43.85 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.408 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 34.2 mm-40 -60.61 -34.1 73.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.033 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.941 HD12 ' CB ' ' A' ' 45' ' ' MET . 0.1 OUTLIER -68.86 -47.02 66.99 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.284 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -53.72 -37.23 63.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.877 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.543 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 1.0 OUTLIER -81.14 -50.74 9.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.048 179.546 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.572 HD22 HD12 ' A' ' 22' ' ' LEU . 3.9 mt -60.18 -39.54 86.85 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 -178.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.24 -46.95 81.55 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -177.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.507 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.5 OUTLIER -50.98 -50.48 74.6 Favored Pre-proline 0 CA--C 1.535 0.393 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.264 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.543 ' CD ' ' O ' ' A' ' 76' ' ' THR . 50.5 Cg_endo -69.86 -24.09 29.59 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 122.313 2.009 . . . . 0.0 112.946 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.952 ' CD2' HD22 ' A' ' 22' ' ' LEU . 1.3 t80 -67.84 -53.48 26.55 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.769 0.319 . . . . 0.0 110.89 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.12 -29.31 60.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.523 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.12 -47.51 57.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.39 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.2 mmmm -56.98 -38.99 73.8 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.496 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.505 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.6 OUTLIER -73.85 -33.89 64.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.54 179.779 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -42.47 99.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.133 0.492 . . . . 0.0 109.757 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.88 -32.4 65.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.181 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.52 ' CE2' ' CD2' ' A' ' 27' ' ' PHE . 22.0 t80 -73.55 -28.72 62.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.956 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 85' ' ' TYR . 4.8 mt . . . . . 0 C--N 1.329 -0.302 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.528 0.204 . . . . 0.0 111.048 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.411 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -70.26 -39.23 75.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.704 -0.226 . . . . 0.0 110.396 -179.946 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.506 HD22 ' O ' ' A' ' 55' ' ' GLN . 0.6 OUTLIER -65.67 -44.77 85.24 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 179.062 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.57 HD12 ' HB1' ' A' ' 66' ' ' ALA . 42.4 mm -62.06 -54.45 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.05 179.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.7 t -61.42 -34.29 75.13 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 120.815 0.34 . . . . 0.0 110.276 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.411 ' HB2' ' O ' ' A' ' 9' ' ' ASP . . . -59.11 -40.33 85.04 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.933 -179.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.481 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -68.96 -43.64 72.16 Favored Glycine 0 N--CA 1.454 -0.154 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 177.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.515 HD11 ' HG2' ' A' ' 73' ' ' GLU . 1.7 mm? -54.27 -58.62 6.69 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.081 -1.06 . . . . 0.0 109.613 178.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.554 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -60.84 -29.36 69.46 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.038 178.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.439 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 5.5 mt-10 -65.27 -48.9 71.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.977 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.506 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -65.49 -50.14 66.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.654 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -51.65 68.59 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.066 0.46 . . . . 0.0 110.787 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.554 HG23 ' O ' ' A' ' 16' ' ' LYS . 70.6 t -62.34 -28.26 44.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.477 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.98 HD11 ' CH2' ' A' ' 44' ' ' TRP . 1.5 tp -66.71 -46.45 75.51 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.818 HD13 ' HB2' ' A' ' 81' ' ' PHE . 2.1 mt -62.42 -38.1 88.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.776 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -24.88 34.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.31 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.454 ' C ' ' H ' ' A' ' 26' ' ' VAL . 3.1 tt0 -113.11 21.16 15.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.7 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.588 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -70.25 34.59 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.295 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.588 ' O ' ' O ' ' A' ' 25' ' ' GLN . 16.5 t 31.93 115.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 178.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.498 ' HB3' ' CZ ' ' A' ' 88' ' ' PHE . 2.7 m-85 . . . . . 0 CA--C 1.515 -0.369 0 CA-C-O 121.741 0.781 . . . . 0.0 110.682 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.452 ' HG ' ' N ' ' A' ' 32' ' ' VAL . 2.7 pt? . . . . . 0 CA--C 1.532 0.261 0 CA-C-O 120.618 0.246 . . . . 0.0 111.452 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.452 ' N ' ' HG ' ' A' ' 31' ' ' LEU . 13.7 p -74.49 138.92 20.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.411 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.8 p -80.31 175.37 10.71 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.016 0.436 . . . . 0.0 111.574 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.885 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -66.76 -38.89 87.51 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.117 -179.152 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.68 -36.07 82.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.287 0.565 . . . . 0.0 110.303 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.93 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -74.03 -34.81 64.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.427 178.77 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.791 ' O ' HG23 ' A' ' 41' ' ' VAL . 19.7 tpp -67.46 -47.31 70.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.629 178.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.885 HG23 ' O ' ' A' ' 34' ' ' GLU . 49.0 t -56.64 -47.66 81.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.423 179.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -58.07 -46.06 86.07 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.93 HG23 ' O ' ' A' ' 36' ' ' ASP . 48.2 t -59.13 -37.67 69.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.78 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 37' ' ' MET . 34.7 t -65.44 -49.13 80.17 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.781 0.324 . . . . 0.0 110.78 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.456 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 1.3 tt0 -55.37 -46.55 76.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.105 0.479 . . . . 0.0 110.777 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.625 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -71.74 -36.32 70.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.996 179.613 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.98 ' CH2' HD11 ' A' ' 21' ' ' LEU . 4.1 m0 -65.03 -45.82 83.87 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.523 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.828 ' CB ' HD12 ' A' ' 74' ' ' LEU . 1.6 ptm -71.41 -37.49 71.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.527 -179.399 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -71.34 -39.28 71.44 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.625 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.05 -45.88 92.97 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.058 179.194 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -61.64 -47.99 82.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.199 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.469 HG22 ' N ' ' A' ' 50' ' ' ASN . 0.6 OUTLIER -54.48 -55.28 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.217 -179.458 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.469 ' N ' HG22 ' A' ' 49' ' ' ILE . 30.0 t30 -69.46 -37.3 77.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.008 0.432 . . . . 0.0 111.09 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.461 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 21.2 t80 -61.26 -43.8 98.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.864 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.552 ' O ' HG22 ' A' ' 56' ' ' VAL . 23.5 m-85 -75.51 -29.29 59.46 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.244 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.795 ' CB ' HD21 ' A' ' 67' ' ' LEU . 10.4 ttm180 -57.55 -27.55 62.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.949 0.404 . . . . 0.0 110.172 178.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -101.81 -15.4 16.93 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.506 ' O ' HD22 ' A' ' 10' ' ' LEU . 26.5 mm-40 -97.53 46.21 1.03 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.821 0.343 . . . . 0.0 111.63 -179.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.833 HG21 ' HB3' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -125.3 164.62 24.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.299 -179.616 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 18.7 p -134.46 171.47 14.26 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 79.23 -149.95 33.03 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.016 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.98 156.12 92.46 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.822 0.344 . . . . 0.0 111.273 -179.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.517 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 42.8 Cg_endo -67.67 -25.94 39.79 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.73 2.287 . . . . 0.0 112.681 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.12 -41.68 93.16 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.894 0.378 . . . . 0.0 111.359 -179.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -61.1 -46.78 89.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.498 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.833 ' HB3' HG21 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.48 -50.81 68.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.207 0.527 . . . . 0.0 109.684 179.471 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -55.26 -41.4 72.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.693 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.462 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 14.5 ttmt -63.05 -49.91 72.7 Favored 'General case' 0 C--N 1.334 -0.104 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.656 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.57 ' HB1' HD12 ' A' ' 11' ' ' ILE . . . -57.23 -34.46 68.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.848 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.795 HD21 ' CB ' ' A' ' 53' ' ' ARG . 7.4 mp -71.81 -39.53 69.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.825 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 7.2 pt20 -73.2 -47.0 47.21 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.813 0.34 . . . . 0.0 110.403 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.49 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -62.32 -39.72 93.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.127 179.614 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.734 ' O ' HD23 ' A' ' 74' ' ' LEU . 7.0 mt -61.84 -48.89 78.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.197 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -55.45 -44.68 76.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.813 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.58 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -70.53 -38.26 74.21 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.142 0.496 . . . . 0.0 110.342 179.469 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.58 ' N ' ' HG3' ' A' ' 72' ' ' GLN . 1.7 tp10 -65.21 -32.78 74.62 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.24 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.828 HD12 ' CB ' ' A' ' 45' ' ' MET . 0.1 OUTLIER -68.44 -45.91 71.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.515 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -53.7 -39.71 65.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.988 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.481 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 7.3 t -80.74 -50.58 9.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.85 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.498 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.9 mt -58.07 -35.14 70.94 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -179.116 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.44 -38.37 71.33 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.534 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 3.6 m120 -51.75 -50.28 78.51 Favored Pre-proline 0 C--N 1.328 -0.359 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 55.2 Cg_endo -70.08 -28.67 23.42 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.49 2.127 . . . . 0.0 113.18 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.818 ' HB2' HD13 ' A' ' 22' ' ' LEU . 2.3 t80 -65.51 -52.45 52.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.89 0.376 . . . . 0.0 111.4 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 55.0 mt -58.94 -28.64 66.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.841 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.25 -48.0 53.67 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.758 0.313 . . . . 0.0 110.434 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -56.93 -40.5 76.49 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.094 0.473 . . . . 0.0 110.115 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.445 ' CZ ' ' HE2' ' A' ' 37' ' ' MET . 0.1 OUTLIER -70.95 -33.35 70.39 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.29 179.447 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 52.2 mmt-85 -61.52 -41.03 96.71 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.71 -31.11 64.76 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.352 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.498 ' CZ ' ' HB3' ' A' ' 27' ' ' PHE . 43.9 t80 -75.96 -28.75 58.03 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.213 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.455 HD13 ' HA ' ' A' ' 89' ' ' LEU . 2.1 mm? . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.564 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.688 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.152 0 CA-C-O 120.664 0.269 . . . . 0.0 111.038 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.4 -43.78 84.85 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.25 -46.36 90.07 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.801 179.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.688 HD12 ' HA ' ' A' ' 8' ' ' LYS . 12.8 mt -60.66 -54.36 36.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.481 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -53.92 -38.6 65.04 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 120.921 0.391 . . . . 0.0 110.435 179.57 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -58.49 -43.65 89.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.979 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.494 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -66.81 -28.05 73.6 Favored Glycine 0 N--CA 1.452 -0.239 0 N-CA-C 110.076 -1.21 . . . . 0.0 110.076 176.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.1 OUTLIER -68.58 -61.48 1.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.475 -0.862 . . . . 0.0 110.617 179.397 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.602 ' O ' HG23 ' A' ' 20' ' ' VAL . 2.6 mmtp -56.78 -35.38 68.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.143 0.497 . . . . 0.0 110.11 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.1 tt0 -59.87 -50.72 72.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.663 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE2' HD23 ' A' ' 74' ' ' LEU . 0.2 OUTLIER -73.59 -44.74 56.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.472 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.402 ' HA ' HD12 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -60.11 -51.67 68.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.89 0.376 . . . . 0.0 110.774 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 16' ' ' LYS . 47.6 t -66.91 -33.49 63.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.676 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 1.012 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 1.1 tp -68.44 -45.69 71.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.862 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.645 ' CD1' HD22 ' A' ' 77' ' ' LEU . 2.8 mt -63.15 -42.85 99.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.83 0.347 . . . . 0.0 110.814 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -82.8 -23.78 33.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.82 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.478 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -117.58 21.53 12.94 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -178.727 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.476 ' O ' ' C ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -67.05 42.23 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.321 0.105 . . . . 0.0 111.247 179.891 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.478 ' H ' ' C ' ' A' ' 24' ' ' GLN . 16.8 t -6.79 124.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.112 0.965 . . . . 0.0 113.558 -179.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.511 ' HB3' HD21 ' A' ' 31' ' ' LEU . 17.9 m-85 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.722 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.601 HD22 ' HE2' ' A' ' 88' ' ' PHE . 4.0 mt . . . . . 0 C--O 1.231 0.1 0 CA-C-O 121.091 0.472 . . . . 0.0 111.416 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.441 HG22 ' HB2' ' A' ' 36' ' ' ASP . 12.8 p -88.31 153.4 3.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.178 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.9 p -79.67 175.53 10.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.102 0.477 . . . . 0.0 111.806 -178.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.926 ' O ' HG23 ' A' ' 38' ' ' VAL . 14.5 pt-20 -70.3 -41.14 73.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.852 -178.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.34 -36.55 84.49 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.19 0.519 . . . . 0.0 110.496 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.847 ' O ' HG23 ' A' ' 40' ' ' VAL . 2.4 m-20 -73.49 -35.82 65.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.612 178.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.897 ' O ' HG23 ' A' ' 41' ' ' VAL . 2.7 tpt -66.87 -43.12 84.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.503 178.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.926 HG23 ' O ' ' A' ' 34' ' ' GLU . 50.5 t -59.48 -45.68 93.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.264 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -47.14 84.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.114 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.847 HG23 ' O ' ' A' ' 36' ' ' ASP . 22.9 t -58.6 -43.45 87.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.563 179.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 37' ' ' MET . 26.1 t -59.2 -48.83 85.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.589 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.55 -42.03 77.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.582 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -58.18 -46.44 85.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.149 179.368 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 1.012 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 28.8 m0 -60.69 -40.63 92.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.969 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.754 ' HG3' HD13 ' A' ' 74' ' ' LEU . 31.5 ttm -64.2 -50.89 66.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.769 -0.65 . . . . 0.0 112.379 -178.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -70.24 -29.31 66.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.002 0.43 . . . . 0.0 110.18 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.472 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.81 -42.33 97.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.122 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.428 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 27.0 m-85 -73.06 -41.74 63.83 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.527 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.9 mm -55.7 -55.4 17.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.499 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -69.48 -38.37 77.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.965 0.412 . . . . 0.0 110.968 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.413 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.7 t80 -59.89 -46.2 90.09 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.212 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.522 ' CE2' HD11 ' A' ' 70' ' ' LEU . 23.0 m-85 -75.84 -28.93 58.42 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.811 ' HB2' HD21 ' A' ' 67' ' ' LEU . 11.4 ttm180 -65.22 -28.66 69.52 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.746 -0.381 . . . . 0.0 110.757 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -91.49 -21.78 20.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.092 -178.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -94.17 46.1 1.15 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.657 HG11 ' HG3' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -132.19 -176.13 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.237 0.541 . . . . 0.0 112.0 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.985 ' O ' ' N ' ' A' ' 59' ' ' GLU . 1.5 p -128.49 163.67 24.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.399 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.403 ' O ' ' HD2' ' A' ' 60' ' ' PRO . . . -32.81 50.4 0.0 OUTLIER Glycine 0 N--CA 1.473 1.134 0 N-CA-C 115.003 0.761 . . . . 0.0 115.003 -178.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.985 ' N ' ' O ' ' A' ' 57' ' ' THR . 2.2 mm-40 -110.57 65.11 0.44 Allowed Pre-proline 0 N--CA 1.432 -1.346 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 176.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.403 ' HD2' ' O ' ' A' ' 58' ' ' GLY . 6.4 Cg_endo -51.42 -43.37 50.15 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 121.173 1.248 . . . . 0.0 111.015 -178.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -71.02 -36.3 72.36 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.621 178.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 59' ' ' GLU . 0.1 OUTLIER -79.63 -35.05 40.03 Favored 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 119.781 -0.768 . . . . 0.0 111.996 -179.68 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.657 ' HG3' HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -65.84 -52.5 49.92 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 179.758 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.29 -41.55 84.65 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.976 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.44 -45.79 71.58 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 119.946 -0.702 . . . . 0.0 110.077 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.95 -39.72 75.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.116 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.811 HD21 ' HB2' ' A' ' 53' ' ' ARG . 7.2 mp -69.82 -35.33 74.7 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.024 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.451 ' O ' ' HG2' ' A' ' 71' ' ' ARG . 3.9 mm-40 -70.42 -46.97 62.89 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.192 0.52 . . . . 0.0 109.728 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.1 -27.24 67.91 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.178 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.522 HD11 ' CE2' ' A' ' 52' ' ' TYR . 0.5 OUTLIER -73.36 -50.17 23.38 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.433 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 13.9 ptm180 -57.63 -41.56 81.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.304 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -31.36 61.09 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -61.59 -46.77 88.43 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.256 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.754 HD13 ' HG3' ' A' ' 45' ' ' MET . 1.2 mt -67.92 -42.83 80.47 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-O 121.051 0.453 . . . . 0.0 110.182 178.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -52.47 -42.08 63.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.177 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.1 t -81.13 -29.69 34.71 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.815 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.645 HD22 ' CD1' ' A' ' 22' ' ' LEU . 5.9 mt -79.37 -37.86 36.34 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.71 -29.89 59.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.626 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.567 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -51.07 -50.3 76.06 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.885 -178.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.567 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 45.7 Cg_endo -69.4 -31.02 22.98 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.061 1.841 . . . . 0.0 112.39 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.537 ' CD2' HD23 ' A' ' 22' ' ' LEU . 1.1 t80 -69.85 -54.59 12.84 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.602 HD21 HG21 ' A' ' 41' ' ' VAL . 73.7 mt -55.77 -34.45 65.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.146 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.643 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . . . -62.43 -48.28 80.37 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.299 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -44.7 88.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.966 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -71.32 -41.01 70.4 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.643 ' HG2' ' HA ' ' A' ' 83' ' ' ALA . 0.4 OUTLIER -62.75 -36.73 83.97 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.175 -179.71 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.441 ' N ' ' HG3' ' A' ' 86' ' ' ARG . 0.5 OUTLIER -72.82 -36.4 67.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.197 0.522 . . . . 0.0 109.93 178.645 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.601 ' HE2' HD22 ' A' ' 31' ' ' LEU . 18.5 t80 -70.5 -32.86 70.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.687 179.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.2 mm? . . . . . 0 C--N 1.331 -0.235 0 CA-C-O 121.42 0.629 . . . . 0.0 109.622 178.502 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.469 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 120.737 0.303 . . . . 0.0 110.894 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -71.17 -41.13 70.75 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.572 HD21 ' HG3' ' A' ' 55' ' ' GLN . 6.4 tp -62.13 -46.06 90.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.975 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.496 ' CG2' ' N ' ' A' ' 12' ' ' SER . 0.4 OUTLIER -62.99 -53.86 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 C-N-CA 120.506 -0.478 . . . . 0.0 109.743 179.174 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.496 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -55.83 -33.06 64.13 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 120.91 0.386 . . . . 0.0 110.433 179.503 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.01 -41.6 90.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.583 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.498 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.56 -42.44 72.53 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 177.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.477 HD21 ' OE1' ' A' ' 73' ' ' GLU . 3.9 mt -54.52 -59.52 4.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 113.844 -1.178 . . . . 0.0 109.32 178.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.542 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -59.59 -29.42 67.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.739 179.687 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.411 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 7.3 tt0 -68.47 -45.84 71.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.191 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.782 ' CD2' HD23 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -74.3 -48.45 28.31 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.065 -179.825 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 77.7 p -55.69 -49.75 72.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.031 0.444 . . . . 0.0 110.353 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 16' ' ' LYS . 91.3 t -68.24 -33.12 58.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.521 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.581 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 4.5 tp -63.77 -45.9 87.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.798 0.333 . . . . 0.0 110.725 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.664 ' CD1' HD22 ' A' ' 77' ' ' LEU . 4.8 mt -68.5 -36.63 79.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.952 0.406 . . . . 0.0 110.196 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -82.53 -17.54 44.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.505 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.446 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 11.4 mt-30 -111.11 14.25 21.86 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.401 ' HG3' ' CZ ' ' A' ' 81' ' ' PHE . 0.6 OUTLIER -49.47 162.73 0.14 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.734 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.52 131.73 58.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 119.491 1.041 . . . . 0.0 111.372 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 . . . . . 0 C--N 1.325 -0.474 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.939 179.433 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.403 HD23 ' N ' ' A' ' 31' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.522 -0.122 0 CA-C-O 121.07 0.462 . . . . 0.0 111.024 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.2 p -70.41 143.67 14.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.195 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.96 172.14 14.17 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.278 0.561 . . . . 0.0 112.121 -178.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.887 ' O ' HG23 ' A' ' 38' ' ' VAL . 29.3 mt-10 -62.34 -43.78 98.02 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.328 -178.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -34.83 78.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.127 0.489 . . . . 0.0 110.929 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.899 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.2 m-20 -73.99 -36.95 64.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.656 178.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.627 ' O ' HG23 ' A' ' 41' ' ' VAL . 3.5 tpt -66.81 -47.95 70.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.639 178.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 34' ' ' GLU . 44.3 t -55.73 -45.79 79.44 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.236 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -58.12 -46.03 86.27 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.899 HG23 ' O ' ' A' ' 36' ' ' ASP . 46.0 t -57.75 -41.53 79.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.996 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 37' ' ' MET . 21.6 t -70.43 -46.96 68.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.23 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.05 -47.5 80.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.031 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.606 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 3.3 p30 -68.96 -35.05 76.31 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.061 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.581 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 3.9 m0 -60.72 -43.63 97.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.85 178.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.8 mtm -68.5 -45.71 71.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.661 -178.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.46 ' ND2' ' HA ' ' A' ' 43' ' ' ASP . 0.4 OUTLIER -71.58 -32.0 67.57 Favored 'General case' 0 CA--C 1.521 -0.154 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.914 179.707 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.606 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.96 -47.01 86.75 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.697 179.072 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.492 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 12.3 m-85 -65.88 -42.68 90.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.934 0.397 . . . . 0.0 110.582 179.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.407 ' HA ' HD13 ' A' ' 49' ' ' ILE . 12.4 mm -55.63 -55.44 17.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.364 -179.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -72.33 -38.64 68.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.123 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.471 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 13.4 t80 -60.71 -46.38 90.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.998 -179.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.623 ' O ' HG22 ' A' ' 56' ' ' VAL . 30.2 m-85 -75.6 -29.75 59.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.938 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.551 ' CB ' HD21 ' A' ' 67' ' ' LEU . 33.2 ttm180 -61.85 -27.95 69.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.826 0.346 . . . . 0.0 110.575 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -97.08 -16.01 20.71 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -178.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.572 ' HG3' HD21 ' A' ' 10' ' ' LEU . 6.0 pt20 -107.01 43.21 1.19 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.735 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -117.15 156.94 18.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.631 0.253 . . . . 0.0 110.364 178.538 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.4 p -131.08 171.46 13.22 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 85.24 -156.78 31.16 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.776 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -68.6 159.96 79.08 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.742 0.306 . . . . 0.0 111.034 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.412 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 43.3 Cg_endo -67.4 -27.97 39.56 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.641 2.227 . . . . 0.0 112.333 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -42.25 99.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.848 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.45 -46.59 85.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.559 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.735 ' HA ' HG11 ' A' ' 56' ' ' VAL . 7.9 mtt180 -53.74 -51.84 62.06 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.8 -42.15 75.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.563 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.427 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 2.2 tttt -63.75 -31.94 73.28 Favored 'General case' 0 CA--C 1.522 -0.111 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.732 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.69 -40.74 65.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.551 HD21 ' CB ' ' A' ' 53' ' ' ARG . 6.8 mp -71.71 -33.46 68.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.597 -179.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 5.5 pt20 -74.05 -48.97 26.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.868 0.366 . . . . 0.0 110.155 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.411 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 13.6 tt0 -63.11 -33.19 74.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.476 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.7 mt -67.69 -49.33 63.29 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 67.9 ttp85 -55.41 -45.75 76.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.607 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -71.98 -32.78 67.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.202 0.525 . . . . 0.0 109.851 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.477 ' OE1' HD21 ' A' ' 15' ' ' LEU . 15.8 mm-40 -63.49 -46.92 83.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.068 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.782 HD23 ' CD2' ' A' ' 18' ' ' PHE . 0.9 OUTLIER -67.9 -45.25 74.96 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 121.085 0.469 . . . . 0.0 110.396 178.699 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.09 -39.39 63.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.915 -179.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.1 p -80.69 -33.74 35.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.982 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.664 HD22 ' CD1' ' A' ' 22' ' ' LEU . 4.9 mt -73.14 -31.21 64.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.968 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.34 -30.26 61.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -179.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.56 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.6 m-80 -56.4 -50.34 88.24 Favored Pre-proline 0 C--N 1.328 -0.327 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -179.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.56 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 54.1 Cg_endo -69.67 -38.96 7.26 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.415 2.077 . . . . 0.0 112.667 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.519 ' CB ' HD22 ' A' ' 22' ' ' LEU . 6.1 t80 -62.91 -53.47 53.55 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.011 0.434 . . . . 0.0 110.5 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.1 mt -56.02 -30.57 62.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.749 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.522 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.0 -43.24 75.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.957 0.408 . . . . 0.0 110.528 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.3 mtmt -62.2 -43.3 99.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.818 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.441 ' O ' HD23 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -77.28 -33.55 55.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.875 -179.388 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.522 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 8.4 ptm180 -67.1 -38.5 85.76 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.75 -36.26 67.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.657 178.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -71.55 -29.09 64.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.392 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.441 HD23 ' O ' ' A' ' 85' ' ' TYR . 0.7 OUTLIER . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.653 178.451 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.706 0.288 . . . . 0.0 110.512 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -65.89 -45.04 83.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.146 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.576 HD11 ' OE1' ' A' ' 55' ' ' GLN . 2.6 tp -59.9 -45.1 93.6 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 179.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.742 HG22 HD13 ' A' ' 15' ' ' LEU . 37.3 mm -60.05 -54.22 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.2 p -51.09 -32.98 24.13 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.817 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.03 -44.9 71.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.407 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.481 ' HA2' ' OE2' ' A' ' 17' ' ' GLU . . . -66.55 -28.14 73.57 Favored Glycine 0 N--CA 1.452 -0.296 0 N-CA-C 110.694 -0.962 . . . . 0.0 110.694 177.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.742 HD13 HG22 ' A' ' 11' ' ' ILE . 2.6 mp -75.45 -60.68 2.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.388 -0.906 . . . . 0.0 110.964 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.791 ' O ' HG23 ' A' ' 20' ' ' VAL . 12.7 ttpp -60.39 -36.81 78.95 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.712 0.291 . . . . 0.0 110.84 -179.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.481 ' OE2' ' HA2' ' A' ' 14' ' ' GLY . 8.1 pt-20 -67.37 -47.73 69.52 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.486 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.449 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 1.3 t80 -65.98 -44.39 85.01 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.205 179.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 71.2 m -56.84 -51.59 68.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.591 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 16' ' ' LYS . 58.7 t -63.42 -29.36 47.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.412 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.969 HD11 ' CH2' ' A' ' 44' ' ' TRP . 19.1 tp -70.26 -45.88 65.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.471 179.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.777 HD22 ' CD2' ' A' ' 81' ' ' PHE . 6.3 mt -65.95 -40.92 91.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.168 -179.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -82.52 -39.13 22.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.614 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.02 21.15 16.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.706 -179.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.659 ' O ' HG23 ' A' ' 26' ' ' VAL . 0.0 OUTLIER -36.06 -53.66 0.78 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.144 -179.855 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.659 HG23 ' O ' ' A' ' 25' ' ' GLN . 47.2 t 121.48 111.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.149 0.979 . . . . 0.0 110.405 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 8.2 m-30 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.54 179.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.458 -0.071 0 CA-C-O 121.46 0.648 . . . . 0.0 112.256 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.628 HG12 ' OH ' ' A' ' 85' ' ' TYR . 14.1 p -80.45 157.82 4.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.984 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.458 ' N ' HG22 ' A' ' 32' ' ' VAL . 5.9 m -79.18 171.36 15.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.243 0.544 . . . . 0.0 111.687 -178.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.873 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -69.28 -37.5 77.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.943 -178.685 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.65 -32.96 74.6 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.955 0.407 . . . . 0.0 111.031 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.895 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -74.33 -39.51 62.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.985 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.907 ' O ' HG23 ' A' ' 41' ' ' VAL . 4.4 tpp -67.53 -45.17 76.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.881 179.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.873 HG23 ' O ' ' A' ' 34' ' ' GLU . 56.3 t -59.23 -44.35 91.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.611 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -61.05 -46.68 89.72 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.378 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 36' ' ' ASP . 43.2 t -58.8 -43.77 88.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.874 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.907 HG23 ' O ' ' A' ' 37' ' ' MET . 13.8 t -65.29 -46.25 91.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.848 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.69 -45.22 85.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.565 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.445 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -66.46 -42.31 87.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.49 179.495 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.969 ' CH2' HD11 ' A' ' 21' ' ' LEU . 9.5 m0 -60.87 -38.97 87.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.895 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 42.5 mtm -71.06 -42.24 69.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.246 -178.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -72.01 -40.52 68.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.852 0.358 . . . . 0.0 110.302 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.452 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -63.65 -39.37 94.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.019 179.382 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.43 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 1.6 m-85 -66.47 -48.46 69.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.063 -179.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.496 HG22 ' N ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -57.42 -55.75 19.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.758 -179.532 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.496 ' N ' HG22 ' A' ' 49' ' ' ILE . 33.9 t30 -63.14 -38.68 92.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.932 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.452 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 4.3 t80 -62.85 -45.93 90.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.621 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.528 ' CD1' ' NE2' ' A' ' 55' ' ' GLN . 32.7 m-85 -70.51 -30.39 67.14 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -178.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.589 ' HA ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -61.23 -19.39 61.6 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.019 179.633 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -102.42 -16.69 16.11 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.142 0.794 . . . . 0.0 113.142 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.576 ' OE1' HD11 ' A' ' 10' ' ' LEU . 0.7 OUTLIER -100.18 46.16 0.96 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 120.617 -0.433 . . . . 0.0 112.081 -179.307 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.968 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -120.08 159.72 21.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.961 0.41 . . . . 0.0 111.106 179.396 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.6 p -134.71 171.74 13.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 82.56 -161.71 40.88 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.273 -0.965 . . . . 0.0 112.95 179.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.77 162.72 26.32 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-O 120.816 0.341 . . . . 0.0 111.007 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.56 -32.02 32.16 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.567 2.178 . . . . 0.0 112.557 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.54 -42.53 96.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.008 0.432 . . . . 0.0 111.047 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -62.35 -46.76 87.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.528 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.968 ' HA ' HG11 ' A' ' 56' ' ' VAL . 5.5 mtt180 -53.56 -52.13 60.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.286 0.565 . . . . 0.0 109.492 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -55.42 -42.23 73.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.45 -178.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.442 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 1.0 OUTLIER -61.76 -34.65 76.23 Favored 'General case' 0 CA--C 1.521 -0.137 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.506 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.506 ' HB1' HD11 ' A' ' 11' ' ' ILE . . . -71.29 -43.59 66.83 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.086 179.112 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.589 HD11 ' HA ' ' A' ' 53' ' ' ARG . 1.1 mp -66.08 -38.69 88.9 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.709 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 0.6 OUTLIER -70.01 -44.66 68.85 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.231 179.843 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 0.5 OUTLIER -62.3 -34.28 76.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.405 179.467 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.504 HD11 ' CE2' ' A' ' 52' ' ' TYR . 0.5 OUTLIER -65.1 -49.65 69.16 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.14 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.407 ' HB2' HD11 ' A' ' 49' ' ' ILE . 4.3 ttm-85 -55.28 -48.7 73.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.861 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.434 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.1 OUTLIER -68.68 -31.21 70.16 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.187 0.518 . . . . 0.0 110.092 179.196 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 0.0 OUTLIER -62.17 -45.7 92.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.948 179.761 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.61 -44.39 78.18 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.147 0.499 . . . . 0.0 110.29 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -52.25 -43.43 64.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.142 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.47 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 66.6 m -79.95 -50.48 10.36 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.708 0.289 . . . . 0.0 111.246 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 4.4 mt -56.69 -37.94 71.57 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.43 -37.05 77.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -178.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.529 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.1 t30 -51.65 -50.54 76.66 Favored Pre-proline 0 CA--C 1.534 0.335 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 53.2 Cg_endo -69.94 -34.68 13.51 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.583 2.189 . . . . 0.0 113.338 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.777 ' CD2' HD22 ' A' ' 22' ' ' LEU . 1.4 t80 -64.41 -53.79 42.99 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.698 0.285 . . . . 0.0 110.76 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.1 mt -53.94 -29.93 44.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.65 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.09 -44.7 65.16 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.257 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.0 -43.05 81.35 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.586 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.628 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -73.44 -33.33 64.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.942 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -46.09 83.81 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.93 -32.23 70.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.932 178.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.511 ' CE2' ' CD2' ' A' ' 27' ' ' PHE . 5.6 t80 -72.1 -28.76 63.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.448 179.112 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.537 HD23 ' O ' ' A' ' 85' ' ' TYR . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.022 179.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.564 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.892 0.377 . . . . 0.0 110.954 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -72.76 -44.35 61.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.863 0.363 . . . . 0.0 110.213 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.782 HD11 ' HG3' ' A' ' 55' ' ' GLN . 5.1 tp -59.86 -49.29 78.29 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.361 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.794 HD11 ' HG3' ' A' ' 73' ' ' GLU . 0.1 OUTLIER -57.25 -49.73 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.042 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -55.24 -33.02 62.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.757 179.324 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.413 ' O ' ' HG2' ' A' ' 16' ' ' LYS . . . -67.92 -44.13 77.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.378 -179.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.485 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.59 -40.18 77.89 Favored Glycine 0 C--O 1.229 -0.175 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 177.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.654 HD23 HD11 ' A' ' 77' ' ' LEU . 3.3 mt -54.48 -59.21 4.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 113.761 -1.22 . . . . 0.0 109.557 178.671 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.811 ' O ' HG23 ' A' ' 20' ' ' VAL . 11.0 pttm -59.57 -31.02 69.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.418 179.444 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.2 -46.9 75.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.129 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.584 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -64.11 -49.17 73.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.095 -179.817 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 98.0 p -55.17 -51.41 66.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.875 0.369 . . . . 0.0 111.065 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 16' ' ' LYS . 38.1 t -61.42 -40.58 86.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.155 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.66 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 0.4 OUTLIER -64.47 -46.11 84.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.081 -179.589 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.974 HD22 ' CG ' ' A' ' 81' ' ' PHE . 33.0 mt -62.99 -36.54 83.86 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.301 -179.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -82.65 -22.42 34.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.602 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.467 ' C ' ' H ' ' A' ' 26' ' ' VAL . 1.7 mt-30 -117.4 21.86 12.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.668 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.522 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -66.01 37.08 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -179.162 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.522 ' O ' ' O ' ' A' ' 25' ' ' GLN . 18.4 t 31.6 112.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 178.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 88' ' ' PHE . 34.0 m-85 . . . . . 0 CA--C 1.519 -0.218 0 CA-C-O 121.357 0.599 . . . . 0.0 110.627 178.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.517 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.9 mp . . . . . 0 CA--C 1.521 -0.171 0 CA-C-O 121.131 0.491 . . . . 0.0 111.664 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.65 HG12 ' OH ' ' A' ' 85' ' ' TYR . 13.8 p -76.45 148.9 6.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.33 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.4 m -79.77 172.41 13.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.144 0.497 . . . . 0.0 111.503 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.937 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -67.56 -38.95 84.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.732 -179.131 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -66.74 -37.31 84.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.164 0.507 . . . . 0.0 110.344 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.791 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.1 m-20 -68.55 -39.32 81.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.612 178.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.544 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -66.2 -41.66 89.89 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.478 178.742 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.937 HG23 ' O ' ' A' ' 34' ' ' GLU . 96.7 t -55.85 -47.94 78.98 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.915 179.069 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -46.92 85.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.988 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 36' ' ' ASP . 39.1 t -55.63 -52.03 52.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.76 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 37' ' ' MET . 38.9 t -61.03 -42.91 94.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.446 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.41 -50.24 74.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.451 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.487 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -59.18 -46.3 88.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.439 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.66 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 16.0 m0 -60.7 -40.45 92.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.583 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.431 ' HG3' HD13 ' A' ' 74' ' ' LEU . 3.2 ttp -67.74 -42.9 81.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.8 -179.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -73.51 -34.75 65.41 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.487 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.89 -45.22 90.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.763 179.157 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -65.45 -46.5 79.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.273 -179.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.818 HD11 ' HB2' ' A' ' 71' ' ' ARG . 0.6 OUTLIER -58.53 -55.5 22.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.66 -179.772 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.489 ' N ' HG22 ' A' ' 49' ' ' ILE . 18.1 t30 -62.47 -42.21 99.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.781 179.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.505 ' CD1' ' OE1' ' A' ' 55' ' ' GLN . 13.8 t80 -60.13 -48.89 79.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.771 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.633 ' CE2' HD21 ' A' ' 70' ' ' LEU . 5.3 m-85 -64.5 -33.66 76.41 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -179.374 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.621 ' HA ' HD11 ' A' ' 67' ' ' LEU . 5.8 mtm105 -56.37 -26.35 52.62 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.375 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -99.26 -16.15 18.61 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.782 ' HG3' HD11 ' A' ' 10' ' ' LEU . 1.9 pt20 -103.4 38.9 1.68 Allowed 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.671 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -110.56 159.13 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 178.465 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.437 HG22 ' H ' ' A' ' 58' ' ' GLY . 2.0 m -129.58 171.5 12.53 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.437 ' H ' HG22 ' A' ' 57' ' ' THR . . . 87.36 -155.9 27.61 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.893 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.2 160.33 83.01 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.706 0.289 . . . . 0.0 110.829 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.577 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 27.2 Cg_endo -62.23 -32.64 82.41 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.68 2.253 . . . . 0.0 112.718 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -62.47 -43.11 99.61 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.213 0.53 . . . . 0.0 110.871 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -60.68 -40.9 93.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.016 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.895 ' O ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -58.08 -50.95 71.69 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.686 179.271 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.37 -41.67 72.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.391 -179.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 5.7 tttm -66.52 -49.86 65.12 Favored 'General case' 0 CA--C 1.522 -0.112 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.278 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.42 -37.29 72.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.69 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.895 HD13 ' O ' ' A' ' 63' ' ' ARG . 8.1 mp -66.67 -41.81 87.57 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.093 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.414 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 1.7 pp0? -67.82 -41.7 82.67 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.85 0.357 . . . . 0.0 110.318 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.401 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 0.5 OUTLIER -62.25 -38.61 89.92 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.248 179.691 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.633 HD21 ' CE2' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -61.4 -48.7 80.03 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.011 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.818 ' HB2' HD11 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -55.27 -48.97 73.25 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.088 -179.66 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.6 -32.67 72.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.075 0.464 . . . . 0.0 110.223 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.794 ' HG3' HD11 ' A' ' 11' ' ' ILE . 25.1 mm-40 -60.59 -45.59 93.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.953 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.431 HD13 ' HG3' ' A' ' 45' ' ' MET . 10.1 mt -67.76 -44.44 77.49 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.022 0.439 . . . . 0.0 110.521 178.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -52.64 -42.78 64.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.227 -179.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.1 m -78.29 -32.74 49.59 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.023 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.654 HD11 HD23 ' A' ' 15' ' ' LEU . 2.7 mt -72.72 -30.67 64.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.844 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.79 -28.87 60.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.571 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.7 t30 -58.49 -50.17 89.5 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.822 0.304 . . . . 0.0 111.822 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.571 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 46.7 Cg_endo -69.03 -41.01 5.65 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.462 2.108 . . . . 0.0 113.014 -179.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.974 ' CG ' HD22 ' A' ' 22' ' ' LEU . 5.1 t80 -58.21 -50.18 74.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.033 0.444 . . . . 0.0 110.869 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.1 mt -54.53 -37.24 65.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.327 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.24 -44.27 79.86 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.771 0.319 . . . . 0.0 110.615 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.83 -40.88 76.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.067 0.46 . . . . 0.0 110.34 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.65 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.4 OUTLIER -76.15 -33.36 59.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.632 179.499 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.43 ' HG2' ' N ' ' A' ' 87' ' ' ASP . 0.0 OUTLIER -61.12 -45.92 92.73 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.054 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.43 ' N ' ' HG2' ' A' ' 86' ' ' ARG . 0.4 OUTLIER -71.05 -33.57 70.4 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.071 178.939 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.517 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 16.8 t80 -69.59 -28.81 66.28 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.263 178.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.621 HD23 ' HG3' ' A' ' 34' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.208 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 178.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.459 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.148 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.404 ' N ' ' HG3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -74.79 -46.17 38.71 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.495 -179.79 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.793 HD11 ' HG3' ' A' ' 55' ' ' GLN . 0.5 OUTLIER -59.57 -49.06 79.22 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.787 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.487 ' CG2' ' N ' ' A' ' 12' ' ' SER . 1.2 tt -56.77 -51.64 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.22 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.487 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 3.5 m -51.12 -33.44 26.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.361 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.54 -47.3 55.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.867 0.365 . . . . 0.0 111.085 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -66.93 -27.99 73.62 Favored Glycine 0 C--O 1.229 -0.162 0 N-CA-C 110.169 -1.173 . . . . 0.0 110.169 177.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.722 HD13 HD11 ' A' ' 77' ' ' LEU . 2.3 mm? -71.32 -61.25 1.84 Allowed 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.328 -0.936 . . . . 0.0 110.159 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.779 ' O ' HG23 ' A' ' 20' ' ' VAL . 9.1 tttt -57.74 -36.78 72.54 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.37 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -63.95 -49.61 71.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.677 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.537 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -67.52 -42.53 82.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.956 -179.476 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.1 m -55.48 -50.13 70.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.001 0.429 . . . . 0.0 110.942 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.779 HG23 ' O ' ' A' ' 16' ' ' LYS . 24.7 t -66.47 -39.33 83.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.637 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.902 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 2.8 tp -64.27 -46.13 85.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.743 0.306 . . . . 0.0 111.462 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.607 HD23 ' CD2' ' A' ' 81' ' ' PHE . 0.7 OUTLIER -65.87 -42.35 90.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.05 -179.403 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -82.6 -17.96 42.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.911 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.43 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 13.3 tt0 -117.66 21.61 12.86 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -179.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.631 ' O ' HG23 ' A' ' 26' ' ' VAL . 0.6 OUTLIER -49.6 -67.35 0.27 Allowed 'General case' 0 C--N 1.331 -0.23 0 O-C-N 122.388 -0.195 . . . . 0.0 111.151 179.757 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' ' 25' ' ' GLN . 50.2 t 120.57 119.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.161 0.984 . . . . 0.0 110.667 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 . . . . . 0 C--N 1.331 -0.212 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.977 179.927 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.432 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.0 OUTLIER . . . . . 0 CA--C 1.523 -0.073 0 CA-C-O 120.985 0.421 . . . . 0.0 111.205 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.552 HG12 ' OH ' ' A' ' 85' ' ' TYR . 5.5 p -80.72 157.25 4.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.634 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.67 171.19 15.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.134 0.492 . . . . 0.0 111.5 -178.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.881 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -71.02 -32.0 68.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.28 -179.302 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.08 -35.98 82.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.013 0.435 . . . . 0.0 110.196 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.884 ' O ' HG23 ' A' ' 40' ' ' VAL . 6.2 t70 -70.7 -42.37 70.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.855 179.003 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.857 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -63.1 -44.79 94.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.815 179.13 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.881 HG23 ' O ' ' A' ' 34' ' ' GLU . 58.3 t -57.11 -47.27 84.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.699 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.402 ' CG2' ' N ' ' A' ' 40' ' ' VAL . 0.5 OUTLIER -63.52 -47.36 81.97 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.48 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 36' ' ' ASP . 41.7 t -59.33 -42.94 88.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.725 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.857 HG23 ' O ' ' A' ' 37' ' ' MET . 54.8 t -66.3 -48.6 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.476 179.513 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.08 -44.67 83.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.349 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.492 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -59.07 -48.42 81.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.435 179.506 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.902 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 32.5 m0 -60.84 -41.12 95.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.462 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.454 ' HG3' HD13 ' A' ' 74' ' ' LEU . 22.5 ttm -67.77 -43.0 80.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.64 -179.245 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -73.22 -33.26 65.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.987 0.422 . . . . 0.0 109.906 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.492 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -62.54 -41.89 99.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.856 179.151 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -70.65 -43.02 70.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.707 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.865 HD11 ' HB3' ' A' ' 71' ' ' ARG . 2.2 mm -56.23 -55.1 20.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.966 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.0 m-80 -68.36 -40.14 81.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.01 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.414 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.5 t80 -59.06 -53.66 55.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.722 ' CD1' HD13 ' A' ' 10' ' ' LEU . 23.5 m-85 -68.8 -28.52 66.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.405 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.754 ' HA ' HD21 ' A' ' 67' ' ' LEU . 42.2 ttm-85 -59.72 -28.96 67.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.07 0.462 . . . . 0.0 110.16 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.3 -9.42 19.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.792 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.793 ' HG3' HD11 ' A' ' 10' ' ' LEU . 3.4 tp-100 -95.64 11.96 31.44 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -178.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.88 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -94.89 177.05 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.236 0.541 . . . . 0.0 111.615 -179.813 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 35.0 p -149.53 171.74 16.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.299 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 80.33 -173.98 54.93 Favored Glycine 0 CA--C 1.519 0.296 0 C-N-CA 120.241 -0.98 . . . . 0.0 114.015 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.426 ' O ' ' HD2' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -52.7 152.26 7.04 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.274 -0.463 . . . . 0.0 111.418 -179.172 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.484 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 14.1 Cg_endo -56.82 -33.35 94.34 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.121 2.547 . . . . 0.0 113.3 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.33 -43.17 98.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.134 0.492 . . . . 0.0 110.912 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.53 -46.77 86.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.642 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.88 ' HA ' HG11 ' A' ' 56' ' ' VAL . 0.4 OUTLIER -54.52 -51.88 63.75 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 121.036 0.445 . . . . 0.0 110.045 179.937 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.01 -42.07 75.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.058 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.503 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 25.1 tttm -61.96 -35.07 77.36 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 120.946 0.403 . . . . 0.0 110.989 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -70.68 -40.88 72.67 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.611 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.754 HD21 ' HA ' ' A' ' 53' ' ' ARG . 6.7 mp -70.24 -33.01 71.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.634 -179.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.53 ' HA ' ' HG2' ' A' ' 71' ' ' ARG . 12.1 pt20 -74.71 -48.3 26.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.836 0.35 . . . . 0.0 110.169 179.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.444 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 3.9 mm-40 -62.25 -34.03 75.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.491 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.466 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -68.94 -49.31 59.18 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.4 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.865 ' HB3' HD11 ' A' ' 49' ' ' ILE . 0.5 OUTLIER -55.48 -37.9 68.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.406 -179.999 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.54 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 36.8 mt-30 -71.56 -34.27 69.83 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -41.13 98.68 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.523 179.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 71' ' ' ARG . 5.4 mt -67.9 -45.15 75.21 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.22 0.533 . . . . 0.0 109.748 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -52.35 -41.93 63.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.662 -179.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.466 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 1.1 p -77.32 -50.58 12.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.584 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.722 HD11 HD13 ' A' ' 15' ' ' LEU . 4.0 mt -54.56 -37.73 65.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.068 -179.247 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.2 -27.39 59.58 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.57 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.4 t-20 -52.9 -50.29 82.36 Favored Pre-proline 0 CA--C 1.532 0.268 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.57 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 46.9 Cg_endo -68.8 -36.77 13.04 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.381 2.054 . . . . 0.0 112.609 -179.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.607 ' CD2' HD23 ' A' ' 22' ' ' LEU . 3.3 t80 -68.43 -54.42 17.22 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.008 0.433 . . . . 0.0 110.163 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 19.6 mt -57.15 -37.46 72.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.153 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.483 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -67.98 -40.74 83.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.848 0.356 . . . . 0.0 110.764 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 88' ' ' PHE . 0.1 OUTLIER -61.64 -39.63 91.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.038 0.447 . . . . 0.0 110.171 179.5 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.797 ' O ' HD13 ' A' ' 89' ' ' LEU . 1.2 t80 -77.53 -38.04 49.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.931 179.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.483 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 14.4 ptt180 -62.46 -47.95 81.78 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.11 -39.81 95.78 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.432 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 6.1 t80 -64.56 -28.45 69.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.742 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.797 HD13 ' O ' ' A' ' 85' ' ' TYR . 6.1 mp . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.899 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.504 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 120.682 0.277 . . . . 0.0 110.959 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -64.74 -42.04 95.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.93 0.395 . . . . 0.0 110.08 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.485 HD11 HE21 ' A' ' 55' ' ' GLN . 0.9 OUTLIER -63.14 -44.83 94.46 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.659 178.959 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.504 HD12 ' HA ' ' A' ' 8' ' ' LYS . 37.0 mt -60.52 -54.25 37.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.461 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 79.5 p -52.18 -41.98 63.08 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-O 120.828 0.347 . . . . 0.0 110.646 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.33 -40.91 83.36 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.033 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.459 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -68.62 -27.95 73.48 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 176.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.2 OUTLIER -71.22 -61.63 1.7 Allowed 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 114.478 -0.861 . . . . 0.0 111.166 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.589 ' O ' HG23 ' A' ' 20' ' ' VAL . 6.6 mmtm -59.19 -33.81 71.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.267 0.556 . . . . 0.0 109.951 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -62.69 -50.87 69.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.877 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.516 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -74.34 -41.75 60.55 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.849 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.409 ' HG ' ' HA ' ' A' ' 16' ' ' LYS . 80.2 p -62.27 -51.64 66.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.804 0.335 . . . . 0.0 110.662 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' ' 16' ' ' LYS . 54.2 t -65.86 -35.44 75.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.444 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.859 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 1.9 tp -68.9 -43.62 74.86 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.037 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.891 HD13 ' HB2' ' A' ' 81' ' ' PHE . 1.5 mt -69.41 -31.36 69.67 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.703 0.261 . . . . 0.0 111.703 -179.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -75.71 -28.94 58.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.484 ' C ' ' H ' ' A' ' 26' ' ' VAL . 4.1 mp0 -117.66 -51.53 2.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.324 0.583 . . . . 0.0 111.547 -179.454 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.859 ' HG3' ' O ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER 64.44 -36.18 0.18 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.778 179.074 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.505 HG23 ' C ' ' A' ' 25' ' ' GLN . 4.7 t 80.91 109.62 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.812 0.339 . . . . 0.0 110.359 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.517 ' CZ ' ' CE1' ' A' ' 85' ' ' TYR . 20.7 m-85 . . . . . 0 CA--C 1.513 -0.462 0 CA-C-O 121.754 0.788 . . . . 0.0 111.819 -178.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 mt . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 121.09 0.471 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.596 HG22 ' HB2' ' A' ' 36' ' ' ASP . 13.8 p -78.59 146.51 7.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.239 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.1 p -79.73 171.69 14.79 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.077 0.465 . . . . 0.0 112.006 -178.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.6 ' O ' HG23 ' A' ' 38' ' ' VAL . 4.3 tt0 -63.52 -48.09 78.98 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.317 -178.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -59.24 -33.4 70.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.516 0.674 . . . . 0.0 110.117 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.914 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.1 m-20 -73.22 -33.25 65.25 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.055 178.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.544 ' HG3' ' CD2' ' A' ' 85' ' ' TYR . 0.0 OUTLIER -67.43 -47.27 70.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.451 178.27 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 34' ' ' GLU . 38.8 t -55.7 -46.52 79.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.299 179.281 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -44.52 88.18 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.914 HG23 ' O ' ' A' ' 36' ' ' ASP . 45.4 t -57.96 -48.15 84.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.54 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 37' ' ' MET . 43.1 t -59.91 -48.73 86.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.655 179.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.47 ' OE1' HG12 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -55.05 -45.08 75.25 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.324 179.77 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.599 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -66.41 -43.59 85.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.029 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.627 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 8.3 m0 -62.25 -43.31 99.11 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.175 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.495 ' HA ' HD12 ' A' ' 74' ' ' LEU . 16.7 mtm -67.75 -43.62 79.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.044 -178.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -72.65 -34.87 67.57 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.235 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.599 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -65.91 -42.98 89.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.033 179.158 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -67.3 -48.32 67.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.847 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.533 HG22 ' N ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -59.58 -55.42 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.405 -179.484 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.533 ' N ' HG22 ' A' ' 49' ' ' ILE . 11.0 t30 -60.15 -41.16 92.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.967 0.413 . . . . 0.0 110.907 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.498 ' CG ' ' OE1' ' A' ' 55' ' ' GLN . 6.3 t80 -62.33 -50.97 69.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.717 -179.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.459 ' OH ' ' HA3' ' A' ' 14' ' ' GLY . 17.4 m-85 -64.79 -30.78 71.8 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -178.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.691 ' HA ' HD21 ' A' ' 67' ' ' LEU . 2.1 mtt180 -58.97 -21.53 58.75 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 119.923 -0.711 . . . . 0.0 110.447 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -100.7 -18.7 16.39 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.498 ' OE1' ' CG ' ' A' ' 51' ' ' TYR . 2.5 mt-30 -93.6 47.15 1.22 Allowed 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 120.83 -0.348 . . . . 0.0 111.141 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.904 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -128.82 165.84 27.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.312 0.577 . . . . 0.0 112.3 -179.633 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.82 171.74 14.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.204 -0.907 . . . . 0.0 108.867 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 83.7 -170.83 48.58 Favored Glycine 0 CA--C 1.516 0.154 0 C-N-CA 120.202 -0.999 . . . . 0.0 113.018 179.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.23 145.51 73.91 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-O 120.661 0.267 . . . . 0.0 111.067 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.518 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 12.0 Cg_endo -55.03 -19.96 21.84 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.931 2.421 . . . . 0.0 112.794 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.34 -40.75 77.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.798 0.332 . . . . 0.0 110.972 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.36 -47.01 71.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.39 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.904 ' HA ' HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -60.17 -50.75 72.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.462 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -54.58 -41.18 69.57 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.999 -179.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -60.48 -49.74 76.34 Favored 'General case' 0 CA--C 1.523 -0.078 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.113 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.444 ' O ' ' HG2' ' A' ' 69' ' ' GLU . . . -57.2 -39.61 75.76 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.78 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.691 HD21 ' HA ' ' A' ' 53' ' ' ARG . 3.6 mp -68.77 -37.98 79.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.12 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -70.81 -46.45 62.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.904 0.383 . . . . 0.0 110.271 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 66' ' ' ALA . 8.7 pt-20 -62.19 -35.93 80.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.108 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.466 ' HA ' HD22 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -63.33 -49.52 73.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.74 179.404 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.7 ttt-85 -55.46 -46.28 76.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.792 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.413 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -68.11 -38.35 82.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.15 0.5 . . . . 0.0 110.127 179.403 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 3.1 tp10 -64.47 -35.92 82.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.64 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 45' ' ' MET . 0.1 OUTLIER -68.55 -46.31 69.82 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.282 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -52.57 -39.24 61.32 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.956 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.524 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 6.8 t -80.86 -48.61 12.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.811 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.462 ' O ' HD12 ' A' ' 22' ' ' LEU . 2.0 mt -58.18 -40.72 82.22 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.25 75.93 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.537 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.9 m120 -51.03 -50.37 75.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -177.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 55.6 Cg_endo -69.87 -27.7 25.63 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.377 2.051 . . . . 0.0 113.139 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.891 ' HB2' HD13 ' A' ' 22' ' ' LEU . 1.2 t80 -65.49 -53.58 40.52 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.686 0.279 . . . . 0.0 111.123 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 61.5 mt -53.39 -29.88 37.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.762 0.315 . . . . 0.0 110.441 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.89 -42.1 63.95 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -58.39 -43.19 88.43 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.564 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.544 ' CD2' ' HG3' ' A' ' 37' ' ' MET . 0.4 OUTLIER -72.38 -34.83 68.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.474 179.84 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -45.74 89.6 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -71.58 -30.02 65.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.921 178.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -70.34 -29.25 65.9 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.155 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.9 mm? . . . . . 0 C--N 1.33 -0.282 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.665 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.471 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.456 -0.17 0 CA-C-O 120.771 0.32 . . . . 0.0 111.015 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -71.55 -45.26 62.81 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.495 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.625 HD12 ' HD1' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -59.84 -46.64 88.61 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.327 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.628 HG13 HD21 ' A' ' 70' ' ' LEU . 3.7 tt -61.74 -53.73 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.828 179.208 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.484 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 8.0 t -57.38 -33.14 67.52 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-O 120.596 0.236 . . . . 0.0 111.478 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.29 78.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.287 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.457 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -71.74 -33.7 63.13 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 177.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.467 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.7 mm? -58.51 -61.16 2.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.093 -1.053 . . . . 0.0 109.51 178.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.732 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.4 OUTLIER -57.57 -35.48 70.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.219 0.533 . . . . 0.0 110.068 179.551 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.34 -48.57 80.7 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.536 179.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.527 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -70.57 -47.18 61.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.843 -179.944 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 89.3 p -55.49 -49.12 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.851 0.358 . . . . 0.0 110.709 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.732 HG23 ' O ' ' A' ' 16' ' ' LYS . 47.8 t -68.08 -31.72 53.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.597 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.947 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 6.2 tp -66.23 -45.69 79.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.825 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.754 HD22 ' CG ' ' A' ' 81' ' ' PHE . 8.2 mt -68.68 -38.93 80.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.222 -179.528 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.28 -27.37 32.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.823 0.344 . . . . 0.0 111.109 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.495 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -112.04 21.56 15.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.109 -179.783 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.66 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -66.25 37.25 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -179.199 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.66 ' O ' ' O ' ' A' ' 25' ' ' GLN . 6.1 m 15.24 125.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 179.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.413 ' HB3' ' CE2' ' A' ' 88' ' ' PHE . 17.8 m-85 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.319 178.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.2 mt . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.818 0.342 . . . . 0.0 110.971 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.555 HG12 ' OH ' ' A' ' 85' ' ' TYR . 9.6 p -73.42 142.29 15.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.31 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.0 t -79.86 172.5 13.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.154 0.502 . . . . 0.0 111.618 -178.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.893 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -66.52 -40.64 89.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.918 -179.017 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -66.16 -36.83 84.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.246 0.545 . . . . 0.0 110.246 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.898 ' O ' HG23 ' A' ' 40' ' ' VAL . 8.9 t0 -71.62 -35.47 70.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.485 178.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.823 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -68.37 -44.47 75.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.59 178.594 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 34' ' ' GLU . 60.9 t -56.25 -47.44 80.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.244 179.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -59.35 -46.74 87.79 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.049 179.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.898 HG23 ' O ' ' A' ' 36' ' ' ASP . 42.5 t -58.59 -44.59 89.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.532 179.466 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.823 HG23 ' O ' ' A' ' 37' ' ' MET . 30.9 t -62.98 -48.91 85.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.487 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.96 -44.11 70.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.49 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.474 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -67.63 -39.05 84.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.422 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.947 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 7.3 m0 -62.84 -44.98 94.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 53.2 mtm -67.13 -45.78 76.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.416 -178.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -66.52 -41.72 88.38 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.436 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.474 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.38 -43.35 92.91 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.875 179.177 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.507 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 7.1 m-85 -61.13 -52.0 66.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.61 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.521 HD12 ' HA ' ' A' ' 49' ' ' ILE . 0.2 OUTLIER -54.43 -55.17 16.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.228 -179.295 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.501 ' N ' HG22 ' A' ' 49' ' ' ILE . 28.7 t30 -64.74 -35.58 81.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.098 0.475 . . . . 0.0 110.234 179.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.551 ' CE1' ' NE2' ' A' ' 55' ' ' GLN . 6.3 t80 -64.8 -35.06 79.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.986 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.96 ' CD2' HD13 ' A' ' 70' ' ' LEU . 26.0 m-85 -75.78 -35.52 60.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.745 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.552 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.1 OUTLIER -60.65 -29.4 69.25 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.692 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -93.62 -14.8 26.04 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -178.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.551 ' NE2' ' CE1' ' A' ' 51' ' ' TYR . 3.5 mt-30 -104.89 43.72 1.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.564 ' HB ' ' CG ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -127.67 168.24 21.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.873 0.368 . . . . 0.0 111.02 178.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.6 p -139.4 171.25 14.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.825 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.65 -152.88 25.48 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.472 -0.871 . . . . 0.0 112.92 179.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.68 152.75 89.41 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-O 120.848 0.356 . . . . 0.0 111.163 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.515 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 43.7 Cg_endo -67.74 -22.33 43.58 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.737 2.291 . . . . 0.0 113.053 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -63.4 -42.02 98.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.668 -179.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.38 -39.73 81.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.257 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.564 ' CG ' ' HB ' ' A' ' 56' ' ' VAL . 1.2 mpt_? -59.32 -51.17 71.1 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.249 0.547 . . . . 0.0 109.595 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.97 -41.14 86.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.855 -179.577 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.502 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 9.9 tttp -68.04 -50.11 57.31 Favored 'General case' 0 C--N 1.338 0.092 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.585 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.61 -32.39 70.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.503 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.552 HD11 ' CB ' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -71.71 -40.17 69.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.435 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.534 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 3.0 pt20 -66.62 -36.84 83.56 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.534 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.2 tt0 -69.24 -35.09 75.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.002 179.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.96 HD13 ' CD2' ' A' ' 52' ' ' TYR . 4.0 mt -65.49 -49.27 69.68 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.45 -48.89 73.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.317 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.505 ' HG2' ' HA ' ' A' ' 69' ' ' GLU . 7.7 pt20 -64.14 -36.52 84.3 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 178.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 2.9 tp10 -63.08 -37.22 86.34 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.512 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.444 HD23 ' CE2' ' A' ' 18' ' ' PHE . 23.9 mt -68.16 -45.68 72.83 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.3 m120 -52.95 -38.46 62.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.863 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.441 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 5.6 t -80.86 -49.3 11.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.508 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.8 mt -56.44 -35.25 67.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.205 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.62 -31.67 62.06 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.558 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.2 t-20 -51.65 -50.16 78.81 Favored Pre-proline 0 CA--C 1.533 0.319 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.558 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 55.5 Cg_endo -69.84 -32.33 18.43 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.442 2.095 . . . . 0.0 113.119 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.754 ' CG ' HD22 ' A' ' 22' ' ' LEU . 6.2 t80 -65.89 -53.67 36.6 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.886 0.374 . . . . 0.0 110.914 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.6 mt -56.33 -31.31 63.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.756 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.421 ' O ' ' HG3' ' A' ' 86' ' ' ARG . . . -69.08 -46.18 68.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.834 0.35 . . . . 0.0 110.392 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -58.02 -42.47 85.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.698 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.555 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.5 OUTLIER -73.03 -33.55 65.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.0 -179.933 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.51 ' HG3' ' N ' ' A' ' 87' ' ' ASP . 0.0 OUTLIER -63.03 -39.4 94.62 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.935 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.51 ' N ' ' HG3' ' A' ' 86' ' ' ARG . 6.7 m-20 -72.8 -32.44 65.56 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.029 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.413 ' CE2' ' HB3' ' A' ' 27' ' ' PHE . 7.7 t80 -71.14 -28.92 64.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.713 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.456 179.165 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.5 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.772 0.32 . . . . 0.0 110.954 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.87 -45.25 52.11 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.47 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.506 HD11 ' HG3' ' A' ' 55' ' ' GLN . 10.6 tp -61.63 -46.38 90.03 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.106 0.479 . . . . 0.0 109.713 178.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.611 HD11 ' HG3' ' A' ' 69' ' ' GLU . 2.6 tt -61.36 -53.6 46.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.648 179.009 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.492 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 6.6 t -52.12 -33.09 38.33 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.909 0.385 . . . . 0.0 110.554 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -67.79 -41.72 82.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.75 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.533 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -70.88 -35.98 65.56 Favored Glycine 0 C--O 1.23 -0.141 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mp -59.75 -61.01 2.93 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 113.829 -1.186 . . . . 0.0 109.929 179.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.711 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.3 tptp -59.06 -37.09 76.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.229 0.538 . . . . 0.0 110.253 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 6.7 tp10 -61.3 -46.85 88.58 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.386 179.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.478 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.3 OUTLIER -71.12 -49.32 45.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.1 -179.781 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 91.3 p -55.85 -46.36 78.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.907 0.385 . . . . 0.0 110.419 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.711 HG23 ' O ' ' A' ' 16' ' ' LYS . 63.0 t -68.32 -32.91 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.392 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.66 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 6.6 tp -62.62 -45.98 90.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.793 0.33 . . . . 0.0 110.587 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.911 HD22 ' CG ' ' A' ' 81' ' ' PHE . 9.8 mt -72.95 -30.59 63.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.612 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -82.66 -30.14 29.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.542 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.491 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 1.0 OUTLIER -107.91 9.92 28.61 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.473 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.38 160.22 0.17 Allowed 'General case' 0 C--O 1.232 0.184 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 177.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 11.3 p -112.08 138.14 42.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 119.931 1.241 . . . . 0.0 110.158 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.455 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.4 m-85 . . . . . 0 C--N 1.326 -0.454 0 CA-C-O 121.524 0.678 . . . . 0.0 110.591 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.55 HD22 ' HE2' ' A' ' 88' ' ' PHE . 18.2 mt . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.911 0.386 . . . . 0.0 110.817 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.406 HG12 ' OH ' ' A' ' 85' ' ' TYR . 7.2 p -73.15 140.38 17.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.777 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.7 p -80.04 173.77 12.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.107 0.48 . . . . 0.0 111.856 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.907 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -62.81 -44.38 96.32 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.082 -179.106 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.32 -36.89 84.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.124 0.488 . . . . 0.0 110.542 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.911 ' O ' HG23 ' A' ' 40' ' ' VAL . 2.4 m-20 -71.55 -36.49 70.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.343 178.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.449 ' HE1' ' HZ ' ' A' ' 81' ' ' PHE . 5.3 tpt -66.91 -45.0 79.31 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.436 178.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.907 HG23 ' O ' ' A' ' 34' ' ' GLU . 77.8 t -55.6 -45.91 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.16 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.026 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -45.45 91.1 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.049 0.452 . . . . 0.0 109.865 178.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.911 HG23 ' O ' ' A' ' 36' ' ' ASP . 36.7 t -55.64 -47.66 78.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.015 179.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 37' ' ' MET . 39.4 t -68.41 -41.69 83.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.799 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -56.24 -47.17 79.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.975 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.549 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 2.8 p30 -71.56 -34.66 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.246 179.539 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.66 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 2.5 m0 -61.76 -46.61 88.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.418 0.627 . . . . 0.0 110.26 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.474 ' HG2' ' N ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -70.91 -36.6 72.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.125 -178.918 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.474 ' N ' ' HG2' ' A' ' 45' ' ' MET . 5.0 t30 -73.6 -39.83 64.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.959 0.409 . . . . 0.0 109.936 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.549 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.88 -45.76 91.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.728 179.438 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.468 ' CE1' ' CZ ' ' A' ' 47' ' ' PHE . 6.8 m-85 -64.71 -46.23 83.19 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.644 179.753 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.43 HG22 HH12 ' A' ' 53' ' ' ARG . 3.5 mm -55.18 -55.17 17.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.147 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -68.76 -37.69 79.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.955 0.407 . . . . 0.0 110.921 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.446 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.7 t80 -61.93 -43.07 99.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.91 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.694 ' O ' HG22 ' A' ' 56' ' ' VAL . 24.0 m-85 -75.66 -30.86 59.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.94 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.651 ' HG3' HD21 ' A' ' 67' ' ' LEU . 27.0 ttm105 -61.57 -30.53 70.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.998 0.428 . . . . 0.0 110.411 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -103.49 -10.97 18.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.397 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.506 ' HG3' HD11 ' A' ' 10' ' ' LEU . 9.5 tp-100 -96.33 21.85 8.53 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.729 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -102.12 174.06 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.138 0.494 . . . . 0.0 111.638 -179.599 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.0 p -143.8 171.43 14.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.433 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 83.66 -151.74 28.15 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.302 -0.951 . . . . 0.0 113.08 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.458 ' O ' ' HD3' ' A' ' 63' ' ' ARG . 13.8 mm-40 -75.15 159.45 82.5 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-O 120.726 0.298 . . . . 0.0 111.158 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.435 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 42.2 Cg_endo -67.6 -29.06 37.22 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.794 2.329 . . . . 0.0 113.861 -178.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.538 ' HG2' ' N ' ' A' ' 62' ' ' GLU . 8.8 pm0 -66.16 -39.13 89.54 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.945 0.403 . . . . 0.0 111.021 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.538 ' N ' ' HG2' ' A' ' 61' ' ' GLN . 18.3 mt-10 -64.17 -46.68 82.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.19 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.729 ' HA ' HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.61 -50.89 68.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.222 0.534 . . . . 0.0 109.611 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -55.46 -41.68 73.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.67 -178.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.434 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 8.5 mttt -61.69 -49.93 74.52 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.477 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.425 ' HA ' ' HG2' ' A' ' 69' ' ' GLU . . . -57.4 -35.84 70.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.857 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.651 HD21 ' HG3' ' A' ' 53' ' ' ARG . 6.6 mp -68.78 -37.93 79.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.434 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.435 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 0.0 OUTLIER -70.68 -43.82 68.29 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 179.538 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.611 ' HG3' HD11 ' A' ' 11' ' ' ILE . 9.1 pt-20 -67.65 -26.55 66.28 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.244 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.424 HD22 ' HA ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -69.55 -49.49 53.85 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.443 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.39 -48.84 73.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.785 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.49 -33.88 73.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.164 0.507 . . . . 0.0 109.88 179.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -58.86 -48.23 82.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.656 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.481 HD23 ' N ' ' A' ' 74' ' ' LEU . 4.6 mt -67.45 -42.96 82.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.983 0.42 . . . . 0.0 110.341 178.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -52.29 -40.83 62.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.915 -179.136 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.7 m -81.0 -50.7 9.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.156 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.423 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 0.5 OUTLIER -57.0 -34.57 68.27 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.355 -179.07 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.3 -30.09 60.26 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 -178.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.567 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -51.74 -49.74 81.56 Favored Pre-proline 0 CA--C 1.535 0.389 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.237 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.567 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.5 Cg_endo -69.54 -36.63 11.04 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.416 2.077 . . . . 0.0 113.235 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.911 ' CG ' HD22 ' A' ' 22' ' ' LEU . 13.6 t80 -65.04 -53.63 42.86 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.992 0.425 . . . . 0.0 110.415 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 20.1 mt -58.2 -29.43 65.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.588 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -66.41 -48.87 68.68 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 110.155 179.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -57.21 -49.14 76.93 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.567 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.406 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -67.74 -33.41 74.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.693 179.854 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.69 -38.07 88.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.163 0.506 . . . . 0.0 109.654 178.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.84 -31.08 64.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.739 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.55 ' HE2' HD22 ' A' ' 31' ' ' LEU . 9.1 t80 -73.23 -37.25 66.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.452 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.131 178.69 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.788 0.327 . . . . 0.0 110.734 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -70.63 -45.15 65.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.598 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.82 HD11 ' CG ' ' A' ' 55' ' ' GLN . 0.3 OUTLIER -60.07 -46.18 90.44 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.273 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.74 HG22 HD12 ' A' ' 15' ' ' LEU . 41.1 mm -61.82 -54.28 36.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.079 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.0 t -61.31 -33.07 72.99 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.69 -43.93 75.04 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.945 -179.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.695 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -70.85 -42.3 61.05 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 177.255 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.74 HD12 HG22 ' A' ' 11' ' ' ILE . 2.1 mt -54.34 -58.7 6.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 113.813 -1.193 . . . . 0.0 109.745 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.533 ' O ' HG23 ' A' ' 20' ' ' VAL . 48.7 tttm -61.77 -31.97 72.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.139 0.495 . . . . 0.0 109.851 179.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.49 -48.54 80.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.252 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.792 ' CE2' HD23 ' A' ' 74' ' ' LEU . 0.5 OUTLIER -72.82 -50.24 25.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.754 -179.904 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.435 ' HA ' HD12 ' A' ' 22' ' ' LEU . 11.1 m -55.41 -51.31 67.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.987 0.423 . . . . 0.0 110.173 179.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 16' ' ' LYS . 95.6 t -65.03 -32.39 58.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.233 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.601 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 3.7 tp -64.19 -45.92 86.22 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.612 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.559 HD22 ' HB2' ' A' ' 81' ' ' PHE . 1.7 mt -66.65 -36.01 81.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.008 0.432 . . . . 0.0 110.129 179.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -82.59 -18.18 42.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.188 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.405 ' N ' ' O ' ' A' ' 20' ' ' VAL . 7.6 mt-30 -107.48 12.24 28.03 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.502 ' HG3' ' CZ ' ' A' ' 81' ' ' PHE . 1.9 mm-40 -50.14 161.97 0.24 Allowed 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 178.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.5 t -109.23 132.08 58.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 119.107 0.867 . . . . 0.0 111.102 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.412 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 5.4 m-85 . . . . . 0 C--N 1.323 -0.584 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.71 179.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.4 mt . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.98 0.419 . . . . 0.0 111.335 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.423 HG12 ' OH ' ' A' ' 85' ' ' TYR . 10.2 p -73.88 154.23 6.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.84 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.81 170.06 17.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.253 0.549 . . . . 0.0 112.117 -178.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.887 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -68.3 -29.52 68.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.591 -179.2 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -34.06 76.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.077 0.465 . . . . 0.0 110.279 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.882 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.3 OUTLIER -71.7 -40.78 69.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.917 179.232 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.807 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -64.63 -45.59 86.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.754 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 34' ' ' GLU . 48.1 t -55.66 -48.16 78.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.875 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.41 HG22 ' O ' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -62.23 -44.86 95.6 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.228 179.638 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.882 HG23 ' O ' ' A' ' 36' ' ' ASP . 53.4 t -59.05 -43.61 89.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.684 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.807 HG23 ' O ' ' A' ' 37' ' ' MET . 35.6 t -67.08 -48.83 77.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.57 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -50.86 71.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.381 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.51 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.7 OUTLIER -60.14 -41.64 93.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.168 179.316 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.601 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 8.4 m0 -60.75 -43.75 97.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.409 179.372 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.586 ' HG3' HD13 ' A' ' 74' ' ' LEU . 0.4 OUTLIER -61.54 -50.67 71.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.228 -178.954 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -68.32 -36.84 79.9 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.51 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.75 -41.15 90.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.783 179.177 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.468 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 4.8 m-85 -70.78 -48.37 54.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.835 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.451 HD13 ' HA ' ' A' ' 49' ' ' ILE . 4.5 mm -53.86 -55.05 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.302 -179.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -68.65 -34.52 75.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.838 0.352 . . . . 0.0 110.966 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.454 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 3.0 t80 -65.36 -44.34 87.95 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.938 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.716 ' O ' HG22 ' A' ' 56' ' ' VAL . 58.8 m-85 -75.43 -33.39 60.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.59 -179.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.794 ' HA ' HD11 ' A' ' 67' ' ' LEU . 29.7 ttm-85 -61.38 -31.22 71.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.664 0.269 . . . . 0.0 111.476 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -96.2 -9.54 30.24 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.82 ' CG ' HD11 ' A' ' 10' ' ' LEU . 4.0 pt20 -113.48 35.47 4.01 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -178.602 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.716 HG22 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -111.75 156.33 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 177.786 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.4 p -122.25 169.84 10.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.82 0.343 . . . . 0.0 110.883 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 91.19 -152.35 21.58 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.505 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.95 163.73 66.19 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 120.765 0.316 . . . . 0.0 110.885 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.44 -27.72 39.58 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.616 2.21 . . . . 0.0 112.547 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -41.91 94.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.96 0.409 . . . . 0.0 110.92 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.77 -46.65 84.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.467 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.469 ' HD3' ' HB ' ' A' ' 56' ' ' VAL . 17.4 mtt85 -55.32 -51.18 67.58 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.255 0.55 . . . . 0.0 109.865 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -55.83 -41.45 74.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.541 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -60.18 -49.9 75.79 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.06 0.457 . . . . 0.0 110.3 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.19 68.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.413 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.794 HD11 ' HA ' ' A' ' 53' ' ' ARG . 4.5 mp -67.5 -39.98 85.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.401 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -70.29 -45.67 65.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.123 0.487 . . . . 0.0 110.012 179.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.435 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 2.7 mt-10 -62.87 -32.93 74.27 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.239 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.691 HD11 ' CE2' ' A' ' 52' ' ' TYR . 0.3 OUTLIER -65.97 -49.32 68.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.148 0.499 . . . . 0.0 109.683 179.247 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.419 ' HA ' HD12 ' A' ' 74' ' ' LEU . 2.3 tmm_? -55.26 -46.18 76.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.728 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.463 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -69.43 -31.89 70.51 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.089 0.471 . . . . 0.0 110.068 179.09 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.463 ' N ' ' HG3' ' A' ' 72' ' ' GLN . 1.0 OUTLIER -61.82 -45.97 91.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.839 179.584 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.792 HD23 ' CE2' ' A' ' 18' ' ' PHE . 1.8 mt -67.36 -44.69 78.39 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 121.157 0.503 . . . . 0.0 110.315 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 26.6 m120 -52.46 -41.2 63.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.855 -179.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.402 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -80.84 -50.56 9.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.037 179.615 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.513 HD22 ' CD1' ' A' ' 22' ' ' LEU . 4.7 mt -56.21 -34.58 66.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.062 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.08 -28.98 61.64 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.569 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 10.6 t30 -53.84 -50.28 84.67 Favored Pre-proline 0 C--N 1.328 -0.333 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 42.1 Cg_endo -68.29 -39.37 10.16 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.474 2.116 . . . . 0.0 113.222 -179.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.559 ' HB2' HD22 ' A' ' 22' ' ' LEU . 5.7 t80 -63.81 -53.53 49.35 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.231 0.538 . . . . 0.0 110.565 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.441 HD21 HG21 ' A' ' 41' ' ' VAL . 88.3 mt -57.57 -31.5 66.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.794 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.477 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -68.3 -45.2 73.66 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.961 0.41 . . . . 0.0 110.772 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -59.62 -41.86 91.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.059 0.457 . . . . 0.0 110.587 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.438 ' O ' ' HG ' ' A' ' 89' ' ' LEU . 0.2 OUTLIER -77.57 -35.71 52.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.691 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 22.3 ptt180 -64.17 -39.49 94.12 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.568 -0.453 . . . . 0.0 109.819 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.59 -36.99 68.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.72 178.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -69.6 -29.24 66.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.486 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 85' ' ' TYR . 6.2 mt . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.479 178.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.814 0.34 . . . . 0.0 110.551 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.77 -44.51 89.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.086 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.493 HD22 ' HA ' ' A' ' 10' ' ' LEU . 0.3 OUTLIER -59.91 -46.54 89.04 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.226 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.747 HD13 ' HE2' ' A' ' 52' ' ' TYR . 35.3 mm -57.79 -53.75 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.821 178.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.508 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 25.1 p -53.0 -42.87 66.02 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.285 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.4 91.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.557 0.218 . . . . 0.0 111.261 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.458 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.91 -28.03 72.38 Favored Glycine 0 CA--C 1.518 0.227 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 177.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.577 HD12 HG22 ' A' ' 11' ' ' ILE . 0.4 OUTLIER -67.35 -61.48 1.89 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.211 -0.994 . . . . 0.0 110.691 179.452 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.761 ' O ' HG23 ' A' ' 20' ' ' VAL . 5.1 mmtt -59.69 -39.18 83.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.308 0.575 . . . . 0.0 109.634 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -59.37 -50.64 73.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.956 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.534 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -69.85 -42.7 73.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.985 -179.756 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.46 -51.06 71.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.991 0.424 . . . . 0.0 110.426 179.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.761 HG23 ' O ' ' A' ' 16' ' ' LYS . 61.1 t -63.29 -33.55 61.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.657 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.953 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 34.9 tp -62.37 -46.14 89.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.826 0.346 . . . . 0.0 110.777 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.832 HD22 ' CG ' ' A' ' 81' ' ' PHE . 36.7 mt -66.25 -41.29 90.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.073 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -80.03 -21.21 43.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.429 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.484 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -117.55 21.48 12.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.223 -179.691 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.653 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.1 OUTLIER -66.93 36.55 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.118 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.653 ' O ' ' O ' ' A' ' 25' ' ' GLN . 22.4 m 8.45 127.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 . . . . . 0 C--N 1.328 -0.366 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.211 178.606 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.415 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.0 OUTLIER . . . . . 0 N--CA 1.462 0.153 0 CA-C-O 121.049 0.452 . . . . 0.0 112.172 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.597 HG12 ' OH ' ' A' ' 85' ' ' TYR . 11.1 p -76.46 152.67 5.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.024 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.0 m -79.97 172.19 14.1 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.204 0.526 . . . . 0.0 111.912 -178.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.91 ' O ' HG23 ' A' ' 38' ' ' VAL . 2.0 mp0 -66.64 -40.74 88.84 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.221 -178.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -37.01 85.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.109 0.48 . . . . 0.0 110.461 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.883 ' O ' HG23 ' A' ' 40' ' ' VAL . 5.0 m-20 -71.91 -35.73 69.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.511 178.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.601 ' O ' HG23 ' A' ' 41' ' ' VAL . 5.5 tpt -67.16 -45.55 76.7 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.506 178.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.91 HG23 ' O ' ' A' ' 34' ' ' GLU . 49.1 t -55.67 -46.74 79.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.232 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -46.87 85.01 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.162 179.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 36' ' ' ASP . 25.5 t -55.83 -51.52 59.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.651 179.367 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 37' ' ' MET . 32.0 t -58.08 -46.42 88.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.544 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.71 -47.09 74.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.466 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.544 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 1.0 OUTLIER -56.83 -48.58 77.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.948 179.833 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.953 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 33.2 m0 -60.76 -42.27 97.12 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.122 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.709 ' HG3' HD13 ' A' ' 74' ' ' LEU . 2.9 ttp -61.86 -50.96 70.17 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.196 -0.457 . . . . 0.0 112.042 -178.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -72.62 -29.6 63.61 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.544 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 1.1 t80 -64.02 -45.47 88.78 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.832 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -69.49 -42.62 74.53 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.306 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 15.1 mm -54.14 -55.29 15.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.197 -179.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.547 ' HA ' ' HG2' ' A' ' 53' ' ' ARG . 13.0 m-80 -66.64 -34.87 78.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.301 0.572 . . . . 0.0 110.171 179.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.479 ' HB2' ' O ' ' A' ' 47' ' ' PHE . 6.6 t80 -62.78 -40.22 96.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.044 179.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.934 ' O ' HG23 ' A' ' 56' ' ' VAL . 5.3 m-85 -75.47 -38.71 59.43 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -178.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.547 ' HG2' ' HA ' ' A' ' 50' ' ' ASN . 4.8 ptp85 -58.75 -31.64 68.52 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.122 -179.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -91.49 -11.38 37.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.591 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.469 ' HG2' ' CE1' ' A' ' 51' ' ' TYR . 2.5 mp0 -96.58 -18.62 19.64 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.134 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.934 HG23 ' O ' ' A' ' 52' ' ' TYR . 14.5 t -68.78 160.39 4.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.08 0.467 . . . . 0.0 111.886 -179.257 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.537 ' N ' HG12 ' A' ' 56' ' ' VAL . 19.4 p -133.88 171.11 14.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.509 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 90.9 -151.08 20.95 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.934 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.401 ' O ' ' HD2' ' A' ' 63' ' ' ARG . 0.5 OUTLIER -78.11 162.91 65.25 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.707 0.289 . . . . 0.0 110.984 -179.853 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -60.98 -28.34 86.14 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.715 2.277 . . . . 0.0 112.761 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -43.29 99.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.131 0.491 . . . . 0.0 110.679 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.23 -46.66 88.99 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.211 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.613 ' HG3' ' HB ' ' A' ' 56' ' ' VAL . 3.7 mpt_? -54.04 -51.19 64.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.05 0.452 . . . . 0.0 110.014 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.43 -41.97 73.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.314 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.421 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 2.2 ttmm -66.66 -32.06 73.14 Favored 'General case' 0 CA--C 1.523 -0.069 0 O-C-N 122.082 -0.386 . . . . 0.0 110.852 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -71.07 -38.33 72.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.464 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.541 HD21 ' HB3' ' A' ' 53' ' ' ARG . 8.9 mp -70.03 -35.05 74.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.588 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 3.3 pp0? -73.81 -46.35 45.81 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.373 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -62.34 -35.65 79.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.522 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.441 HD21 ' CD1' ' A' ' 52' ' ' TYR . 2.1 tp -66.09 -49.02 69.02 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -55.23 -45.65 75.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.796 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.04 -33.53 65.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.041 0.448 . . . . 0.0 110.056 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.447 ' O ' HG22 ' A' ' 76' ' ' THR . 0.4 OUTLIER -60.77 -48.0 83.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.752 179.808 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.709 HD13 ' HG3' ' A' ' 45' ' ' MET . 4.5 mt -67.67 -44.8 76.96 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.931 0.396 . . . . 0.0 110.535 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -52.69 -40.17 62.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.326 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.447 HG22 ' O ' ' A' ' 73' ' ' GLU . 12.1 t -80.87 -34.73 33.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.265 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.431 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 0.6 OUTLIER -72.97 -30.16 63.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.996 -179.276 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.26 -29.4 60.16 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.569 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 15.3 m-20 -54.76 -50.23 87.06 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.2 Cg_endo -69.78 -37.87 8.52 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.459 2.106 . . . . 0.0 112.74 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.832 ' CG ' HD22 ' A' ' 22' ' ' LEU . 1.8 t80 -62.75 -53.42 54.58 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 110.415 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 93.2 mt -55.03 -27.64 46.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.283 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.47 -45.46 62.49 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.457 179.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 80' ' ' PRO . 7.6 mttt -56.86 -42.94 80.65 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.146 0.498 . . . . 0.0 109.925 179.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.597 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.2 OUTLIER -75.34 -33.39 61.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.445 179.143 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -44.49 96.28 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.24 -33.55 69.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.007 178.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.415 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 2.9 t80 -71.49 -28.91 64.24 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.017 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.739 HD12 ' OE1' ' A' ' 34' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.421 179.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 120.803 0.335 . . . . 0.0 110.568 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -65.15 -42.63 93.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.155 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.967 HD13 ' CE2' ' A' ' 52' ' ' TYR . 0.2 OUTLIER -59.72 -48.22 82.53 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.717 179.324 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.642 HG22 HD13 ' A' ' 15' ' ' LEU . 41.0 mm -59.13 -53.79 43.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.073 178.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 72.3 m -57.21 -33.11 67.18 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.011 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.17 91.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.183 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.508 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.75 -41.87 72.7 Favored Glycine 0 CA--C 1.511 -0.201 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 177.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.642 HD13 HG22 ' A' ' 11' ' ' ILE . 0.9 OUTLIER -54.4 -58.9 5.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 113.824 -1.188 . . . . 0.0 109.624 178.824 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.707 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -59.68 -30.92 69.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.373 179.465 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.33 -47.26 74.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.449 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.553 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -71.32 -46.11 61.42 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.71 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 82.9 p -55.51 -51.6 66.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 0.0 110.749 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.707 HG23 ' O ' ' A' ' 16' ' ' LYS . 48.3 t -66.59 -33.27 62.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.967 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.883 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 2.6 tp -66.76 -45.78 77.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.01 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.784 HD22 ' HB2' ' A' ' 81' ' ' PHE . 4.5 mt -68.23 -35.11 77.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.855 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.47 -34.24 31.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.91 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.66 ' O ' HG23 ' A' ' 26' ' ' VAL . 4.8 tt0 -104.8 18.81 21.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.233 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.497 ' O ' HG23 ' A' ' 26' ' ' VAL . 0.0 OUTLIER -39.37 -59.37 1.08 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.762 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 24' ' ' GLN . 42.4 t 98.92 130.19 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.534 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.448 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.1 m-85 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.979 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.499 HD22 ' HE2' ' A' ' 88' ' ' PHE . 3.9 mt . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.963 0.411 . . . . 0.0 111.114 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 11.6 p -74.55 144.92 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.825 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.86 173.36 12.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.085 0.469 . . . . 0.0 111.734 -178.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.88 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.1 OUTLIER -64.61 -42.81 95.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.141 -179.121 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -66.07 -37.25 85.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.071 0.462 . . . . 0.0 110.756 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.874 ' O ' HG23 ' A' ' 40' ' ' VAL . 3.9 m-20 -71.57 -37.84 71.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.819 179.046 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.765 ' O ' HG23 ' A' ' 41' ' ' VAL . 1.4 tpt -67.91 -45.14 75.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.704 178.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 34' ' ' GLU . 96.1 t -56.41 -44.14 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.448 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -45.57 92.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.924 0.392 . . . . 0.0 110.142 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.874 HG23 ' O ' ' A' ' 36' ' ' ASP . 39.2 t -60.11 -44.23 94.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.533 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.765 HG23 ' O ' ' A' ' 37' ' ' MET . 38.8 t -65.06 -49.11 81.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.62 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.83 -42.94 80.54 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.237 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.402 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -60.26 -41.0 92.33 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.071 0.462 . . . . 0.0 109.774 179.022 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.883 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 10.7 m0 -60.52 -39.35 87.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.249 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.524 ' HA ' HD12 ' A' ' 74' ' ' LEU . 52.0 mtm -68.07 -45.99 72.3 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -178.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -34.35 73.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.03 0.443 . . . . 0.0 110.07 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.449 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -62.8 -46.19 89.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.098 179.32 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -66.61 -47.39 72.79 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.12 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.43 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.3 OUTLIER -55.31 -55.09 18.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.027 -179.681 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.496 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 8.0 m-80 -66.68 -36.85 83.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.131 0.491 . . . . 0.0 110.727 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.449 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 4.7 t80 -64.65 -39.27 93.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.142 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.967 ' CE2' HD13 ' A' ' 10' ' ' LEU . 7.5 m-85 -75.64 -36.75 60.1 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.815 ' HB3' HD21 ' A' ' 67' ' ' LEU . 8.8 ptp180 -58.13 -28.48 64.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.089 0.471 . . . . 0.0 110.8 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -95.49 -8.57 34.91 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.596 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -95.7 -7.83 36.3 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.634 ' HB ' ' HD2' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -85.14 178.29 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.172 0.511 . . . . 0.0 111.715 -178.962 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.0 p -144.91 171.4 14.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.288 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.85 -144.85 19.72 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.901 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -79.17 163.69 58.48 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.724 0.297 . . . . 0.0 110.975 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.474 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 45.4 Cg_endo -67.7 -22.74 43.22 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.666 2.244 . . . . 0.0 112.777 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.17 -43.13 92.71 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.938 0.399 . . . . 0.0 110.733 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -60.82 -44.58 96.73 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.081 179.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.634 ' HD2' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.52 -50.96 68.6 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.225 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -55.28 -41.94 72.95 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.535 -178.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.461 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 0.8 OUTLIER -66.33 -34.41 77.93 Favored 'General case' 0 C--O 1.231 0.101 0 O-C-N 122.103 -0.373 . . . . 0.0 110.955 -179.819 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.487 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -69.48 -38.48 77.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.089 0.471 . . . . 0.0 110.032 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.815 HD21 ' HB3' ' A' ' 53' ' ' ARG . 8.1 mp -68.45 -35.94 78.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.395 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 6.0 pt20 -76.08 -48.91 19.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.811 0.338 . . . . 0.0 110.815 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.44 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.2 mt-10 -61.98 -41.98 98.63 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.519 -179.543 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.551 HD22 ' CD2' ' A' ' 52' ' ' TYR . 9.5 tp -66.68 -49.1 67.2 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.73 -43.27 76.44 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.431 179.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.4 -41.25 76.67 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.158 0.504 . . . . 0.0 109.65 179.111 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 3.2 tp10 -58.55 -39.41 80.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.601 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.524 HD12 ' HA ' ' A' ' 45' ' ' MET . 1.3 mt -67.98 -45.53 73.91 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.202 0.525 . . . . 0.0 109.813 178.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -52.52 -37.19 56.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.563 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.425 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -80.83 -50.6 9.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.69 179.148 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.474 HD22 ' CD1' ' A' ' 22' ' ' LEU . 3.8 mt -57.81 -35.02 70.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.506 -178.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.16 -30.89 60.86 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.565 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.0 OUTLIER -51.52 -49.97 79.48 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.086 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.565 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 51.1 Cg_endo -69.4 -34.1 16.52 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.43 2.087 . . . . 0.0 112.961 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.784 ' HB2' HD22 ' A' ' 22' ' ' LEU . 3.3 t80 -66.97 -53.85 27.64 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.902 0.382 . . . . 0.0 110.22 179.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 90.6 mt -60.6 -27.57 67.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.783 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.529 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -70.25 -42.67 71.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.051 0.453 . . . . 0.0 110.465 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.69 -42.9 94.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.299 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -72.66 -42.71 64.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.519 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.529 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 9.1 ptm180 -59.84 -35.4 74.67 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.55 -35.32 67.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.343 178.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.499 ' HE2' HD22 ' A' ' 31' ' ' LEU . 15.1 t80 -69.89 -28.55 65.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.004 179.198 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.6 mm? . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.141 179.202 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.639 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.733 0.301 . . . . 0.0 110.713 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.92 -45.0 83.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.48 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.473 HD21 ' HD1' ' A' ' 52' ' ' TYR . 2.7 tp -60.81 -46.09 91.88 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.211 0.529 . . . . 0.0 109.691 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.639 HD12 ' HA ' ' A' ' 8' ' ' LYS . 12.9 mt -60.48 -53.81 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.962 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.435 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 4.1 m -55.2 -33.65 63.22 Favored 'General case' 0 C--O 1.227 -0.107 0 CA-C-O 120.912 0.387 . . . . 0.0 110.468 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.06 -41.34 95.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.588 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.494 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -70.39 -40.41 69.09 Favored Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 109.126 -1.59 . . . . 0.0 109.126 176.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.605 HD13 HG22 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -54.64 -60.02 3.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.908 -1.146 . . . . 0.0 110.454 179.135 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.665 ' O ' HG23 ' A' ' 20' ' ' VAL . 15.7 tttm -60.8 -34.65 74.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.164 0.507 . . . . 0.0 110.092 179.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.44 -47.76 84.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.214 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.563 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -69.81 -50.31 44.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.852 -179.76 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.612 ' HA ' HD12 ' A' ' 22' ' ' LEU . 61.6 m -55.44 -51.6 66.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.05 0.452 . . . . 0.0 110.836 179.871 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.665 HG23 ' O ' ' A' ' 16' ' ' LYS . 58.3 t -63.66 -33.76 63.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.646 179.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.88 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 1.0 OUTLIER -66.24 -45.95 78.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.647 179.878 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.821 HD22 ' HB2' ' A' ' 81' ' ' PHE . 2.6 mt -61.93 -37.75 85.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.015 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -82.52 -19.29 38.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.034 179.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.432 ' HG3' ' HA ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -109.58 21.28 17.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.425 -179.683 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.801 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.8 OUTLIER -74.31 29.45 0.08 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.295 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.801 ' O ' ' O ' ' A' ' 25' ' ' GLN . 22.9 t 19.78 133.31 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 N-CA-C 113.815 1.042 . . . . 0.0 113.815 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 . . . . . 0 C--N 1.33 -0.241 0 CA-C-O 121.245 0.545 . . . . 0.0 110.804 178.854 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.455 HD21 ' HE2' ' A' ' 88' ' ' PHE . 9.8 mt . . . . . 0 N--CA 1.456 -0.144 0 CA-C-O 121.037 0.446 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.529 HG12 ' OH ' ' A' ' 85' ' ' TYR . 11.5 p -74.82 148.04 8.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.86 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.8 m -79.88 172.46 13.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.073 0.463 . . . . 0.0 111.671 -178.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.846 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -70.32 -29.34 66.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.355 -179.442 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.56 -36.57 78.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.983 0.42 . . . . 0.0 110.436 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.895 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.6 OUTLIER -74.11 -36.68 64.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.912 -0.586 . . . . 0.0 109.703 178.938 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.824 ' O ' HG23 ' A' ' 41' ' ' VAL . 2.5 tpt -67.74 -47.29 69.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.615 178.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.846 HG23 ' O ' ' A' ' 34' ' ' GLU . 92.3 t -56.27 -46.06 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.167 179.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -58.36 -47.15 84.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.137 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 36' ' ' ASP . 42.6 t -59.0 -40.92 81.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.759 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 37' ' ' MET . 20.3 t -67.32 -48.88 76.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.696 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.96 -46.27 78.63 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.529 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -64.39 -41.14 96.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.55 179.542 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.88 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 7.5 m0 -60.83 -42.88 98.6 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.777 179.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.418 ' HA ' HD13 ' A' ' 74' ' ' LEU . 4.6 ttp -68.17 -43.53 78.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.299 -178.44 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -72.42 -34.05 67.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.896 0.379 . . . . 0.0 110.054 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.517 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.03 -43.81 97.67 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.116 179.441 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -69.09 -45.72 69.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.334 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.691 HD11 ' HB3' ' A' ' 71' ' ' ARG . 2.0 mm -55.25 -55.7 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.364 -179.273 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.459 ' HA ' ' HD2' ' A' ' 53' ' ' ARG . 20.8 m-80 -65.5 -36.28 83.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.145 0.498 . . . . 0.0 110.731 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.527 ' CD1' ' HG3' ' A' ' 55' ' ' GLN . 0.7 OUTLIER -62.19 -45.61 92.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.517 -179.497 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.546 ' CD2' HD13 ' A' ' 70' ' ' LEU . 17.3 m-85 -76.01 -33.46 59.68 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -178.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 49' ' ' ILE . 0.8 OUTLIER -63.53 -24.99 68.05 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 119.849 -0.741 . . . . 0.0 110.755 -179.697 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -98.79 -16.01 19.07 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.527 ' HG3' ' CD1' ' A' ' 51' ' ' TYR . 7.0 mm-40 -102.09 45.85 0.95 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.563 ' HB ' ' CD ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -125.0 173.54 10.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.173 0.511 . . . . 0.0 111.496 179.353 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.435 ' O ' ' NE ' ' A' ' 63' ' ' ARG . 12.1 p -144.17 171.16 14.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.183 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.49 -155.52 30.97 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.2 -1.0 . . . . 0.0 112.891 179.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.46 ' O ' ' NE ' ' A' ' 63' ' ' ARG . 1.4 mt-10 -67.9 144.76 97.5 Favored Pre-proline 0 C--N 1.333 -0.15 0 CA-C-O 120.755 0.312 . . . . 0.0 111.221 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.473 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 42.3 Cg_endo -67.45 -25.64 41.46 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.784 2.323 . . . . 0.0 113.084 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.56 -43.89 95.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.13 0.49 . . . . 0.0 110.886 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.44 ' HB2' ' NH2' ' A' ' 63' ' ' ARG . 1.8 mt-10 -60.71 -43.36 97.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.045 179.344 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.704 ' O ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -55.26 -51.39 66.79 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.298 0.57 . . . . 0.0 109.605 179.219 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.33 -41.49 72.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.705 -178.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.427 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 0.2 OUTLIER -63.25 -49.78 72.76 Favored 'General case' 0 CA--C 1.523 -0.081 0 C-N-CA 119.941 -0.704 . . . . 0.0 110.328 179.888 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.94 -40.91 90.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.307 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.704 HD13 ' O ' ' A' ' 63' ' ' ARG . 2.4 mp -61.96 -45.89 91.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.459 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' A' ' 71' ' ' ARG . 2.2 pp0? -66.72 -38.23 86.27 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.189 0.519 . . . . 0.0 110.06 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.89 -30.89 71.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.545 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.546 HD13 ' CD2' ' A' ' 52' ' ' TYR . 1.9 mt -71.02 -49.84 40.62 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.141 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.691 ' HB3' HD11 ' A' ' 49' ' ' ILE . 6.7 ptt85 -56.4 -40.26 74.35 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.455 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 1.1 mt-30 -72.9 -35.91 67.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.227 0.537 . . . . 0.0 109.555 178.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -45.48 94.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.093 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 45' ' ' MET . 11.5 mt -67.87 -45.08 75.53 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.121 0.486 . . . . 0.0 110.329 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.7 -38.17 60.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.756 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.402 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 2.6 p -80.86 -50.7 9.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.137 0.494 . . . . 0.0 110.624 179.212 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.408 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 4.4 mt -56.59 -33.01 65.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.148 -179.196 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.19 -31.02 60.83 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.559 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.4 OUTLIER -51.85 -50.23 79.14 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.228 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.559 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 52.5 Cg_endo -69.73 -33.98 15.6 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.522 2.148 . . . . 0.0 113.177 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.821 ' HB2' HD22 ' A' ' 22' ' ' LEU . 2.2 t80 -66.15 -53.56 36.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.982 0.42 . . . . 0.0 110.505 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.8 mt -58.31 -29.02 65.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.796 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.9 -47.94 60.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.87 0.367 . . . . 0.0 110.475 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -41.42 84.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.527 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.54 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.3 OUTLIER -76.19 -33.41 59.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.759 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 mmt-85 -67.11 -40.5 86.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.045 0.45 . . . . 0.0 110.098 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.66 -36.89 68.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.926 179.057 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.455 ' HE2' HD21 ' A' ' 31' ' ' LEU . 26.4 t80 -72.46 -28.78 63.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.676 179.15 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.553 HD23 ' HG3' ' A' ' 34' ' ' GLU . 2.2 mp . . . . . 0 C--N 1.326 -0.423 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.808 0.337 . . . . 0.0 111.213 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 61.64 116.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.016 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.3 -17.47 62.57 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.991 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.67 -46.66 88.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.92 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -62.69 -56.0 21.7 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.047 0.451 . . . . 0.0 110.232 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 mtpt -58.42 -30.78 67.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.618 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.61 -44.45 82.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.196 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.2 tp -60.04 -45.1 93.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.783 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.538 HG22 HD23 ' A' ' 15' ' ' LEU . 43.6 mm -60.49 -54.23 38.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.878 179.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.8 m -51.92 -33.06 35.49 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.869 0.366 . . . . 0.0 110.697 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.76 -44.42 77.53 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.241 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.466 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.2 -28.22 72.97 Favored Glycine 0 N--CA 1.451 -0.365 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 177.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.538 HD23 HG22 ' A' ' 11' ' ' ILE . 1.7 mm? -70.08 -61.37 1.8 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.52 -0.84 . . . . 0.0 110.253 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.659 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.8 ttpm? -59.3 -36.07 74.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.985 0.421 . . . . 0.0 110.086 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -60.58 -49.39 77.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.275 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.505 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -71.26 -49.31 44.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.391 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.609 ' HA ' HD12 ' A' ' 22' ' ' LEU . 1.3 m -55.36 -51.55 66.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.966 0.413 . . . . 0.0 110.802 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.659 HG23 ' O ' ' A' ' 16' ' ' LYS . 46.3 t -66.45 -34.95 73.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.065 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.864 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 0.5 OUTLIER -65.88 -46.21 79.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.641 0.258 . . . . 0.0 111.199 -179.741 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.66 HD23 ' CD2' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -64.38 -40.91 96.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.951 0.405 . . . . 0.0 110.358 179.857 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -82.78 -17.25 44.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.149 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.445 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -105.35 6.98 33.13 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.851 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -50.77 162.23 0.28 Allowed 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 177.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.7 p -108.24 133.87 51.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 119.322 0.965 . . . . 0.0 110.868 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.454 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.6 m-85 -107.28 95.72 5.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.312 0.577 . . . . 0.0 110.937 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -144.95 144.03 30.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.221 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.598 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 5.4 p-10 -88.2 142.62 31.85 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.557 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.598 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 28.5 Cg_endo -62.32 150.46 62.3 Favored 'Cis proline' 0 C--N 1.349 0.603 0 C-N-CA 123.73 -1.362 . . . . 0.0 112.343 -0.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.56 HD23 ' CE2' ' A' ' 88' ' ' PHE . 3.6 mp -103.14 148.39 25.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.009 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.864 HG22 ' HB3' ' A' ' 36' ' ' ASP . 1.9 p -78.0 146.31 8.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.598 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.1 m -79.76 172.45 13.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.19 0.519 . . . . 0.0 111.809 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.904 ' O ' HG23 ' A' ' 38' ' ' VAL . 3.1 tt0 -64.63 -44.4 90.62 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.841 -178.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -34.49 77.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.185 0.517 . . . . 0.0 110.514 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.873 ' O ' HG23 ' A' ' 40' ' ' VAL . 9.2 t70 -72.22 -38.18 69.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.021 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.889 ' O ' HG23 ' A' ' 41' ' ' VAL . 2.0 tpt -67.81 -43.05 80.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.671 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 34' ' ' GLU . 46.5 t -57.97 -47.27 87.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.479 179.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -59.59 -46.98 87.35 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.858 0.361 . . . . 0.0 110.092 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.873 HG23 ' O ' ' A' ' 36' ' ' ASP . 40.6 t -58.75 -45.06 91.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.515 179.333 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.889 HG23 ' O ' ' A' ' 37' ' ' MET . 40.1 t -61.9 -48.57 87.96 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.383 179.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -58.27 -46.42 86.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.312 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.6 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -57.99 -45.6 86.53 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.076 179.175 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.864 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 10.9 m0 -60.21 -39.54 86.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.217 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.746 ' HG3' HD12 ' A' ' 74' ' ' LEU . 27.4 ttm -71.2 -43.95 66.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.784 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -73.66 -36.45 65.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.984 0.421 . . . . 0.0 110.022 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.6 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.22 -44.59 94.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.053 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -69.77 -43.67 71.7 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.944 0.402 . . . . 0.0 110.459 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.478 ' O ' ' CG ' ' A' ' 53' ' ' ARG . 9.8 mm -54.66 -55.72 14.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.47 ' HA ' ' HG3' ' A' ' 53' ' ' ARG . 11.3 t30 -62.07 -36.63 82.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.337 0.589 . . . . 0.0 110.373 179.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.521 ' HB2' ' O ' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -57.75 -48.53 79.36 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.332 179.72 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.575 ' O ' HG22 ' A' ' 56' ' ' VAL . 23.1 m-85 -75.63 -30.36 59.47 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.48 ' HG2' ' HG ' ' A' ' 67' ' ' LEU . 0.1 OUTLIER -62.77 -28.06 69.72 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.146 179.278 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -97.11 -15.8 20.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.02 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.475 ' HG3' ' CD1' ' A' ' 51' ' ' TYR . 12.2 mm-40 -102.71 45.19 0.97 Allowed 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.678 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -120.83 163.73 18.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.028 0.442 . . . . 0.0 111.144 179.22 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.02 171.6 14.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.565 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 81.19 -156.06 37.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.264 -0.969 . . . . 0.0 113.06 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -68.69 156.96 89.82 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.851 0.358 . . . . 0.0 111.235 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.434 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 43.8 Cg_endo -67.85 -23.34 41.52 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.674 2.249 . . . . 0.0 112.9 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -65.05 -44.07 90.22 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.84 0.352 . . . . 0.0 111.461 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -64.54 -42.77 95.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.079 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.678 ' HA ' HG11 ' A' ' 56' ' ' VAL . 15.8 mtt180 -53.77 -52.34 60.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -57.04 -42.18 80.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.866 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.41 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 0.1 OUTLIER -62.6 -31.86 72.76 Favored 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.55 179.909 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.438 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -72.82 -40.8 65.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.493 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.594 HD13 ' O ' ' A' ' 63' ' ' ARG . 0.6 OUTLIER -70.5 -35.87 73.47 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.556 -179.59 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.423 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 15.5 pt20 -72.82 -47.62 44.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.995 0.426 . . . . 0.0 110.272 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.464 ' O ' ' HB2' ' A' ' 73' ' ' GLU . 12.3 mt-10 -61.96 -36.57 81.84 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.271 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 66' ' ' ALA . 0.2 OUTLIER -64.71 -48.41 74.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.722 0.296 . . . . 0.0 110.253 179.087 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.7 ttt-85 -54.55 -43.45 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -31.78 65.09 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 4.3 tp10 -62.46 -49.48 75.27 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.128 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.746 HD12 ' HG3' ' A' ' 45' ' ' MET . 14.0 mt -67.87 -44.7 76.45 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.053 0.454 . . . . 0.0 110.524 178.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.38 -39.65 61.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.694 -179.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.426 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 27.7 m -80.91 -50.67 9.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.737 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.418 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 1.1 mt -55.8 -33.99 64.9 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.152 -179.185 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.85 -30.93 61.51 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.3 0.481 . . . . 0.0 112.3 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.558 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 4.8 m-20 -51.72 -50.24 78.62 Favored Pre-proline 0 C--N 1.328 -0.326 0 N-CA-C 111.811 0.301 . . . . 0.0 111.811 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.558 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 51.3 Cg_endo -69.65 -36.24 11.47 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.444 2.096 . . . . 0.0 113.092 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.66 ' CD2' HD23 ' A' ' 22' ' ' LEU . 3.4 t80 -62.99 -53.79 48.38 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.044 0.449 . . . . 0.0 110.514 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 59.6 mt -54.96 -31.85 60.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.769 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.81 -44.78 72.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.394 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 80' ' ' PRO . 6.0 mttm -57.39 -43.33 83.55 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.077 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.492 ' OH ' HG12 ' A' ' 32' ' ' VAL . 1.2 t80 -74.14 -33.53 63.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.997 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -45.71 93.65 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.08 -33.0 71.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.623 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.56 ' CE2' HD23 ' A' ' 31' ' ' LEU . 30.5 t80 -67.42 -29.06 68.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.173 179.066 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.5 HD13 ' HA ' ' A' ' 89' ' ' LEU . 0.9 OUTLIER -77.52 -44.12 29.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.613 178.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.8 mmpt? -61.08 -34.32 74.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.943 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 29.1 m -60.95 -12.9 12.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.904 -178.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -63.86 175.19 1.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 177.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.72 ' O ' HD23 ' A' ' 94' ' ' LEU . 2.7 tp10 -120.8 158.8 26.79 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.72 HD23 ' O ' ' A' ' 93' ' ' GLU . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.738 179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.862 0.363 . . . . 0.0 111.119 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.415 ' C ' HD12 ' A' ' 4' ' ' LEU . 4.5 pp -113.52 -18.57 11.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.412 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.4 ttpt -51.1 -39.38 56.02 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.962 0.411 . . . . 0.0 110.743 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.19 -44.18 75.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.763 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -65.09 -43.21 92.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.307 179.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.703 ' HA ' HD12 ' A' ' 11' ' ' ILE . 5.3 tttp -65.17 -36.92 85.75 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.086 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.88 -44.51 92.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.836 0.35 . . . . 0.0 110.268 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.731 HD11 ' HG3' ' A' ' 55' ' ' GLN . 4.3 tp -61.01 -45.79 93.36 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.144 0.497 . . . . 0.0 109.837 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.703 HD12 ' HA ' ' A' ' 8' ' ' LYS . 11.9 mt -60.39 -53.68 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.013 179.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.2 p -54.31 -33.05 57.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.64 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.89 -41.45 82.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.75 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.498 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -70.24 -42.48 66.24 Favored Glycine 0 C--O 1.227 -0.316 0 N-CA-C 109.113 -1.595 . . . . 0.0 109.113 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.493 HD23 HG22 ' A' ' 11' ' ' ILE . 1.7 mm? -54.41 -58.27 8.08 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 113.822 -1.189 . . . . 0.0 109.221 178.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.461 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -60.38 -29.43 68.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.503 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.461 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -68.82 -46.44 68.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.437 179.616 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.579 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -71.83 -46.43 58.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.821 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 79.0 p -55.43 -51.52 66.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.02 0.438 . . . . 0.0 110.366 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.426 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 77.5 t -67.16 -31.11 51.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.564 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.898 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 18.0 tp -64.27 -46.38 83.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.895 0.379 . . . . 0.0 110.237 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.784 HD22 ' HB2' ' A' ' 81' ' ' PHE . 9.4 mt -66.26 -36.61 83.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.256 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.61 -17.41 44.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.386 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.426 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 0.4 OUTLIER -111.81 6.46 19.67 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -179.066 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.522 HE22 HD23 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -48.56 162.59 0.09 Allowed 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 177.594 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 23.5 t -110.66 134.33 53.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 119.592 1.087 . . . . 0.0 110.23 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.42 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 13.4 m-85 -110.58 95.43 5.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.652 0.739 . . . . 0.0 110.916 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -124.01 151.72 43.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.361 -1.29 . . . . 0.0 111.2 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.531 ' HA ' ' N ' ' A' ' 31' ' ' LEU . 0.5 OUTLIER -100.87 145.87 31.13 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.778 179.664 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.98 115.05 3.2 Favored 'Cis proline' 0 C--N 1.35 0.623 0 C-N-CA 123.497 -1.46 . . . . 0.0 112.147 -0.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.538 HD11 ' NE2' ' A' ' 92' ' ' HIS . 1.4 mp -44.32 146.78 0.63 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.967 -179.14 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.437 HG12 ' OH ' ' A' ' 85' ' ' TYR . 9.9 p -77.69 155.98 5.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.729 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.416 ' N ' HG22 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -79.85 171.7 14.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.124 0.488 . . . . 0.0 111.725 -178.612 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.93 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -71.05 -31.68 68.19 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.648 -179.271 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -67.07 -37.01 83.25 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.238 0.542 . . . . 0.0 110.182 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.901 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.4 OUTLIER -72.65 -34.71 67.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.465 178.686 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.723 ' O ' HG23 ' A' ' 41' ' ' VAL . 2.6 tpt -67.78 -46.1 72.98 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.45 178.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.93 HG23 ' O ' ' A' ' 34' ' ' GLU . 59.8 t -55.83 -47.99 78.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.303 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.401 HG22 ' O ' ' A' ' 36' ' ' ASP . 0.5 OUTLIER -58.06 -46.72 84.95 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.896 0.379 . . . . 0.0 110.027 179.362 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.901 HG23 ' O ' ' A' ' 36' ' ' ASP . 46.8 t -57.22 -47.5 84.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.577 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.723 HG23 ' O ' ' A' ' 37' ' ' MET . 32.8 t -61.37 -47.97 91.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.554 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -56.36 -48.53 76.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.505 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.591 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 1.8 m-20 -60.04 -45.07 94.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.681 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.898 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 13.1 m0 -60.72 -42.48 97.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.087 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 39.8 mtm -66.63 -48.74 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -178.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -70.48 -32.84 70.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.977 0.418 . . . . 0.0 110.063 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.591 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -62.75 -42.6 99.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.043 179.338 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.472 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 6.3 m-85 -69.82 -44.81 69.22 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.335 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.458 HD12 ' HA ' ' A' ' 49' ' ' ILE . 0.3 OUTLIER -57.34 -55.29 21.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.937 0.399 . . . . 0.0 110.758 -179.874 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -66.4 -41.19 89.68 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.906 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.492 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 5.0 t80 -60.43 -46.0 91.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.367 -179.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.569 ' O ' HG22 ' A' ' 56' ' ' VAL . 25.9 m-85 -70.19 -31.29 68.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.738 -0.664 . . . . 0.0 112.184 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.911 ' HB2' HD21 ' A' ' 67' ' ' LEU . 34.5 ttm-85 -59.12 -27.96 66.09 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.684 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -94.99 -17.93 21.51 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.731 ' HG3' HD11 ' A' ' 10' ' ' LEU . 5.5 pt20 -105.54 45.13 0.98 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -124.1 163.5 23.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.525 178.792 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 2.4 m -127.07 166.45 17.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.441 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 91.6 -149.79 19.99 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.715 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -80.63 157.02 72.73 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.804 0.335 . . . . 0.0 111.005 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.435 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 42.6 Cg_endo -67.72 -19.75 47.11 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.874 2.383 . . . . 0.0 113.479 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -66.2 -43.98 85.21 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.891 0.376 . . . . 0.0 111.446 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -66.7 -35.43 80.11 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.181 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.532 ' HG3' ' HB ' ' A' ' 56' ' ' VAL . 2.2 mpt_? -59.48 -50.96 71.91 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -58.44 -41.64 85.54 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.548 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -49.67 73.9 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.262 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.486 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.13 -33.76 67.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.269 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.911 HD21 ' HB2' ' A' ' 53' ' ' ARG . 4.2 mp -69.68 -34.28 73.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.279 179.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.539 ' HA ' ' HG2' ' A' ' 71' ' ' ARG . 0.8 OUTLIER -74.43 -48.75 25.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.559 179.506 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.443 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 7.2 mm-40 -63.28 -30.34 71.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.875 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.501 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 1.4 tp -73.65 -48.4 32.65 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.686 -0.406 . . . . 0.0 109.945 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.539 ' HG2' ' HA ' ' A' ' 68' ' ' GLN . 6.7 ptp180 -56.88 -38.48 72.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.441 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.514 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 3.1 pt20 -75.03 -36.0 61.9 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.287 0.565 . . . . 0.0 109.51 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.473 ' OE2' HD11 ' A' ' 15' ' ' LEU . 4.1 mm-40 -62.63 -42.17 99.43 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.397 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.574 HD23 ' CD2' ' A' ' 18' ' ' PHE . 37.6 mt -67.86 -45.21 75.22 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.126 0.489 . . . . 0.0 110.009 178.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -53.78 -38.65 64.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.137 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.7 -34.53 34.54 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.059 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.426 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 3.4 mt -74.5 -28.15 60.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.046 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.08 -29.82 60.77 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.569 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.1 m120 -54.69 -50.19 87.12 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 45.1 Cg_endo -68.74 -37.04 12.75 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.403 2.069 . . . . 0.0 112.81 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.784 ' HB2' HD22 ' A' ' 22' ' ' LEU . 1.5 t80 -63.94 -52.61 58.96 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.087 0.47 . . . . 0.0 110.254 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 60.0 mt -57.04 -28.13 62.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.721 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.97 -46.73 61.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.905 0.383 . . . . 0.0 110.369 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.9 mmmt -57.09 -43.09 81.86 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.296 179.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.518 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.3 OUTLIER -76.05 -33.32 59.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.62 179.551 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.403 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 40.8 mtt180 -64.87 -42.37 94.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.065 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.41 ' HA ' ' HG2' ' A' ' 90' ' ' LYS . 0.4 OUTLIER -72.59 -34.32 67.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.268 0.556 . . . . 0.0 109.73 178.784 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.499 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 6.9 t80 -71.04 -28.71 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.627 179.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.679 HD23 ' HG3' ' A' ' 34' ' ' GLU . 4.2 mp -78.31 -45.47 22.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.083 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.41 ' HG2' ' HA ' ' A' ' 87' ' ' ASP . 0.0 OUTLIER -74.08 -35.38 64.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.499 -179.266 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.402 ' N ' ' HG3' ' A' ' 90' ' ' LYS . 23.2 t -79.16 -8.58 59.12 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.538 ' NE2' HD11 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -79.39 111.97 16.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.965 0.412 . . . . 0.0 111.418 -179.746 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -121.73 122.78 40.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.49 177.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mp . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.338 -0.839 . . . . 0.0 110.895 -179.937 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.553 HD22 ' N ' ' A' ' 3' ' ' LEU . 2.9 mm? . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 120.852 0.358 . . . . 0.0 111.414 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.9 mp 54.05 -89.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.524 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.426 ' HA ' ' HG2' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -56.66 -30.0 62.89 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.03 0.443 . . . . 0.0 110.837 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.16 -44.83 87.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.184 179.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -62.59 -53.45 54.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.462 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.877 ' HA ' HD12 ' A' ' 11' ' ' ILE . 1.6 pttm -61.32 -31.86 71.72 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.736 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.94 -44.57 89.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.343 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.486 HD22 ' O ' ' A' ' 55' ' ' GLN . 1.7 tp -61.99 -43.79 98.1 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.877 HD12 ' HA ' ' A' ' 8' ' ' LYS . 7.6 mt -61.35 -54.36 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.504 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -55.45 -43.05 75.07 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.424 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.488 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -58.86 -43.36 90.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.851 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.687 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.83 -28.32 72.11 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 177.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.504 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.3 OUTLIER -65.41 -61.33 2.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.095 -1.053 . . . . 0.0 110.322 179.053 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.637 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.1 mtpt -58.0 -38.46 76.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.203 0.525 . . . . 0.0 109.932 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.6 tt0 -56.57 -49.57 74.46 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.279 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.665 ' CE2' HD23 ' A' ' 74' ' ' LEU . 0.7 OUTLIER -71.41 -50.58 30.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.553 -179.481 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -51.75 67.0 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.05 0.452 . . . . 0.0 110.776 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.637 HG23 ' O ' ' A' ' 16' ' ' LYS . 48.9 t -64.19 -35.64 74.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.625 179.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.928 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 0.3 OUTLIER -66.27 -45.87 79.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.688 0.28 . . . . 0.0 110.911 -179.855 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.738 HD22 ' CG ' ' A' ' 81' ' ' PHE . 11.1 mt -60.43 -40.26 90.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.885 0.374 . . . . 0.0 110.309 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.57 -21.93 35.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.938 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.479 ' HG3' ' HA ' ' A' ' 21' ' ' LEU . 0.4 OUTLIER -108.91 21.53 17.11 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.753 -179.432 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.664 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -71.07 33.24 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -179.296 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.664 ' O ' ' O ' ' A' ' 25' ' ' GLN . 21.9 t 24.86 120.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 179.045 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -110.34 95.99 5.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.023 0.439 . . . . 0.0 110.573 178.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -149.13 139.9 22.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.35 -179.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.468 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 0.5 OUTLIER -62.69 148.5 91.09 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.695 179.752 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.468 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 46.4 Cg_endo -68.3 138.35 44.47 Favored 'Cis proline' 0 C--N 1.348 0.548 0 C-N-CA 123.589 -1.421 . . . . 0.0 112.408 0.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.491 HD11 ' CE1' ' A' ' 92' ' ' HIS . 4.2 mt -83.86 133.65 34.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.317 -179.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.583 HG22 ' HB3' ' A' ' 36' ' ' ASP . 15.0 p -79.94 150.25 5.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.386 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 73.3 m -79.65 172.92 13.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.153 0.501 . . . . 0.0 111.632 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.959 ' O ' HG23 ' A' ' 38' ' ' VAL . 1.2 tm-20 -67.52 -42.62 82.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.904 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -67.92 -37.79 82.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.19 0.519 . . . . 0.0 110.599 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.829 ' O ' HG23 ' A' ' 40' ' ' VAL . 9.0 t0 -67.96 -37.76 81.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.353 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.547 ' O ' HG23 ' A' ' 41' ' ' VAL . 6.4 tpt -68.43 -39.9 81.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.733 178.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.959 HG23 ' O ' ' A' ' 34' ' ' GLU . 92.6 t -56.77 -45.71 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.123 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.682 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -46.21 91.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.937 178.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.829 HG23 ' O ' ' A' ' 36' ' ' ASP . 37.0 t -55.46 -48.34 77.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.791 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 37' ' ' MET . 22.7 t -67.87 -41.35 84.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.925 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -43.68 79.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.105 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.584 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 2.8 p30 -71.54 -38.62 71.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.246 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.928 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 6.6 m0 -60.98 -41.34 96.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.019 0.438 . . . . 0.0 110.474 178.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.758 ' HG2' HD22 ' A' ' 74' ' ' LEU . 47.8 mtm -71.01 -40.81 71.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.783 -179.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -73.39 -35.21 65.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.028 0.442 . . . . 0.0 110.138 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.584 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -65.44 -42.0 92.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.207 179.603 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.442 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 4.5 m-85 -69.2 -44.39 72.24 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.738 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.577 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -54.39 -54.33 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.321 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.556 ' HA ' ' HG3' ' A' ' 53' ' ' ARG . 20.6 t30 -61.64 -36.75 81.7 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 121.367 0.603 . . . . 0.0 109.886 178.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.451 ' HB2' ' O ' ' A' ' 47' ' ' PHE . 1.1 t80 -59.04 -43.98 91.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.91 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.687 ' OH ' ' HA3' ' A' ' 14' ' ' GLY . 30.2 m-85 -75.36 -30.67 60.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.641 ' HA ' HD11 ' A' ' 67' ' ' LEU . 15.5 mtp85 -60.85 -31.26 70.71 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.63 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -93.36 -13.08 28.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.396 -178.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.486 ' O ' HD22 ' A' ' 10' ' ' LEU . 4.6 mm-40 -107.15 39.99 1.76 Allowed 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.767 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -118.06 153.69 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.298 178.555 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.44 171.54 9.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.365 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.97 -152.93 25.13 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.954 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.401 ' O ' ' HG3' ' A' ' 63' ' ' ARG . 7.7 mt-10 -73.66 161.34 79.24 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-O 120.727 0.299 . . . . 0.0 110.991 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.426 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 42.7 Cg_endo -67.76 -25.1 40.04 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.53 2.153 . . . . 0.0 112.671 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -43.87 81.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.858 0.361 . . . . 0.0 111.138 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -66.65 -44.38 82.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.408 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.767 ' HA ' HG11 ' A' ' 56' ' ' VAL . 11.4 mtt85 -53.65 -51.45 63.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.14 -41.73 84.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.969 -179.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.471 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 8.5 tttp -64.22 -31.12 72.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.946 0.403 . . . . 0.0 110.86 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.756 ' O ' HD23 ' A' ' 70' ' ' LEU . . . -73.85 -34.76 64.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.984 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.641 HD11 ' HA ' ' A' ' 53' ' ' ARG . 3.6 mp -71.71 -36.56 70.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.361 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 6.4 pt20 -71.81 -46.49 58.01 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.417 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.0 OUTLIER -62.78 -33.82 75.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.931 178.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.756 HD23 ' O ' ' A' ' 66' ' ' ALA . 1.5 mm? -64.3 -49.33 72.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.774 179.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.9 tpp85 -55.34 -47.43 75.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.653 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.15 -36.28 79.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.324 0.583 . . . . 0.0 109.658 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -60.96 -42.54 98.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.723 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.758 HD22 ' HG2' ' A' ' 45' ' ' MET . 6.3 mt -67.74 -45.1 75.96 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.215 0.531 . . . . 0.0 109.954 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -52.53 -38.92 60.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.944 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.407 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 3.0 m -80.78 -50.61 9.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.79 -37.76 66.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.057 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.36 -27.84 59.31 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.561 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.7 t-20 -51.62 -50.02 79.55 Favored Pre-proline 0 CA--C 1.533 0.289 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.561 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.6 Cg_endo -69.09 -32.61 20.98 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.304 2.002 . . . . 0.0 113.082 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.738 ' CG ' HD22 ' A' ' 22' ' ' LEU . 10.6 t80 -64.66 -53.72 42.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.913 0.387 . . . . 0.0 110.905 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.3 mt -54.89 -37.82 66.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.185 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.36 -45.65 83.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.803 0.335 . . . . 0.0 110.591 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -58.17 -40.74 82.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.775 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.492 ' HE2' HG13 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -73.82 -33.62 64.23 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.752 179.849 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -43.45 98.81 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -72.68 -31.42 65.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.055 178.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -72.46 -29.08 63.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.905 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 85' ' ' TYR . 3.0 mm? -78.44 -44.96 23.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.257 0.551 . . . . 0.0 110.067 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -75.38 -38.68 59.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.893 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.5 m -78.89 -12.62 60.04 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.491 ' CE1' HD11 ' A' ' 31' ' ' LEU . 4.1 t60 -59.62 107.63 0.62 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.994 0.426 . . . . 0.0 111.323 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -121.16 105.87 11.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.401 178.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.0 pp . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.947 -179.829 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.6 mp . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.862 0.363 . . . . 0.0 111.137 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.521 HD12 ' O ' ' A' ' 4' ' ' LEU . 4.1 pp -161.12 28.01 0.14 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.091 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.6 -36.79 51.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.979 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.17 -46.87 87.26 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.69 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -62.86 -52.98 61.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.23 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.6 mmtp -59.41 -28.35 66.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.636 179.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.69 -45.12 68.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.499 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.467 HD12 ' CD1' ' A' ' 52' ' ' TYR . 0.0 OUTLIER -61.2 -43.65 98.54 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.149 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.779 HD11 ' HB1' ' A' ' 66' ' ' ALA . 41.8 mm -64.0 -54.6 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.917 179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.449 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 35.9 m -57.91 -33.24 68.55 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.745 0.307 . . . . 0.0 110.947 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.45 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -66.12 -42.92 88.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.674 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.488 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -71.14 -38.42 63.44 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 177.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.6 mm? -54.68 -59.96 4.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.018 -1.091 . . . . 0.0 109.447 178.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.607 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.1 OUTLIER -59.43 -33.55 71.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.027 0.441 . . . . 0.0 110.041 179.41 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.0 tp10 -61.27 -49.16 78.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.637 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.599 ' CE2' HD23 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -72.32 -49.09 37.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.845 -179.723 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 87.9 p -55.31 -43.57 75.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.939 0.4 . . . . 0.0 110.381 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 16' ' ' LYS . 87.6 t -74.36 -27.36 21.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.436 179.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.908 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 21.6 tp -68.9 -46.17 69.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.892 0.377 . . . . 0.0 110.305 179.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.977 HD22 ' CD2' ' A' ' 81' ' ' PHE . 9.3 mt -71.94 -35.14 69.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.433 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -82.71 -23.69 33.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.565 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.451 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -109.8 10.62 24.58 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.415 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.4 162.41 0.15 Allowed 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.2 t -110.3 134.98 50.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 119.645 1.111 . . . . 0.0 110.671 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 5.9 m-85 -109.6 95.54 5.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.784 0.802 . . . . 0.0 110.937 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -133.22 153.52 51.47 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.308 -1.315 . . . . 0.0 111.065 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.549 ' HA ' ' N ' ' A' ' 31' ' ' LEU . 3.4 m-20 -96.98 150.1 36.45 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.089 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -77.33 110.56 1.76 Allowed 'Cis proline' 0 C--N 1.35 0.636 0 C-N-CA 123.544 -1.44 . . . . 0.0 112.299 0.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.549 ' N ' ' HA ' ' A' ' 29' ' ' ASP . 1.2 mp -43.23 145.24 0.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.127 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.464 HG22 ' HB2' ' A' ' 36' ' ' ASP . 13.7 p -77.14 153.63 5.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.816 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.85 173.06 12.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.113 0.482 . . . . 0.0 111.636 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.904 ' O ' HG23 ' A' ' 38' ' ' VAL . 2.6 mt-10 -67.75 -39.16 84.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.165 -178.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -68.09 -37.36 81.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.136 0.493 . . . . 0.0 110.701 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.861 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.1 m-20 -70.5 -37.61 74.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.753 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.691 ' O ' HG23 ' A' ' 41' ' ' VAL . 16.2 tpp -66.99 -42.4 85.12 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.561 178.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 34' ' ' GLU . 99.1 t -56.85 -47.94 82.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.197 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -47.52 83.62 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.176 179.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.861 HG23 ' O ' ' A' ' 36' ' ' ASP . 39.1 t -55.7 -43.6 74.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.752 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.691 HG23 ' O ' ' A' ' 37' ' ' MET . 45.6 t -64.96 -45.47 94.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.712 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.46 -49.07 77.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.479 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -58.1 -43.26 87.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.27 -0.423 . . . . 0.0 109.882 179.306 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.908 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 5.3 m0 -60.64 -41.37 94.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.076 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.718 ' HG3' HD13 ' A' ' 74' ' ' LEU . 22.9 ttm -62.48 -50.57 70.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.053 -179.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -69.21 -35.47 76.25 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.472 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.37 -39.37 83.09 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.627 179.158 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.449 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 10.7 m-85 -72.24 -45.74 58.93 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.311 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 10.2 mm -54.07 -55.18 15.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.374 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -70.06 -35.99 74.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.906 0.384 . . . . 0.0 111.169 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.496 ' CE1' ' NE2' ' A' ' 55' ' ' GLN . 2.2 t80 -63.07 -45.8 90.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.502 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.491 ' O ' ' CG2' ' A' ' 56' ' ' VAL . 36.0 m-85 -75.5 -33.1 60.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.857 ' HB2' HD21 ' A' ' 67' ' ' LEU . 12.3 ttp85 -58.56 -30.98 67.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.818 0.342 . . . . 0.0 110.578 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -95.35 -11.07 28.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.889 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.496 ' NE2' ' CE1' ' A' ' 51' ' ' TYR . 1.4 mt-30 -99.86 -5.67 28.07 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -178.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.874 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.8 OUTLIER -73.15 154.01 7.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.711 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 18.7 p -120.87 171.16 8.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.476 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.56 -147.64 23.25 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.69 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.21 164.83 54.42 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.341 . . . . 0.0 110.862 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.405 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 42.6 Cg_endo -67.62 -22.53 44.01 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.616 2.211 . . . . 0.0 112.76 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.407 ' HA ' ' OD2' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -67.29 -44.02 80.31 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.149 0.5 . . . . 0.0 110.778 -179.934 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.6 -41.53 99.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.008 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.874 ' HA ' HG11 ' A' ' 56' ' ' VAL . 12.0 mtt180 -56.9 -51.17 70.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.009 179.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.407 ' OD2' ' HA ' ' A' ' 61' ' ' GLN . 0.3 OUTLIER -57.05 -41.71 79.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.433 -179.118 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.48 -49.73 76.37 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.461 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.779 ' HB1' HD11 ' A' ' 11' ' ' ILE . . . -56.9 -33.37 66.85 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.055 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.857 HD21 ' HB2' ' A' ' 53' ' ' ARG . 5.4 mp -71.18 -33.27 69.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.607 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -72.17 -49.04 38.82 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -62.24 -30.72 71.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.195 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.465 HD11 ' CE2' ' A' ' 52' ' ' TYR . 0.4 OUTLIER -67.39 -49.14 65.13 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 179.068 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.37 -48.32 74.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.783 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -72.11 -31.73 66.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.99 0.424 . . . . 0.0 110.071 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.429 ' OE2' HD11 ' A' ' 15' ' ' LEU . 3.5 mm-40 -61.64 -48.3 81.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.865 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.718 HD13 ' HG3' ' A' ' 45' ' ' MET . 9.2 mt -67.7 -44.68 77.15 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.048 0.451 . . . . 0.0 110.617 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.3 m-20 -52.8 -42.06 64.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.462 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 12.4 t -80.65 -34.19 35.09 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.436 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.479 HD13 ' HD2' ' A' ' 18' ' ' PHE . 2.8 mt -73.5 -30.22 62.99 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.11 -29.89 60.7 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -179.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.562 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 11.7 m-20 -57.33 -50.2 89.53 Favored Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 111.558 0.207 . . . . 0.0 111.558 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.562 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 44.9 Cg_endo -69.8 -37.59 8.86 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.36 2.04 . . . . 0.0 112.649 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.977 ' CD2' HD22 ' A' ' 22' ' ' LEU . 1.5 t80 -64.76 -52.57 56.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.055 0.455 . . . . 0.0 110.678 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.415 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 28.5 mt -57.1 -30.02 64.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.576 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.81 -48.04 64.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.558 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.83 -41.78 78.45 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.949 0.404 . . . . 0.0 110.266 179.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.653 ' CD2' ' HE2' ' A' ' 37' ' ' MET . 0.2 OUTLIER -74.65 -33.2 62.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.294 179.391 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.415 ' HB3' ' O ' ' A' ' 82' ' ' LEU . 0.0 OUTLIER -63.37 -42.45 98.87 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.411 ' HA ' ' HG2' ' A' ' 90' ' ' LYS . 0.3 OUTLIER -72.64 -32.88 66.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.946 178.854 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.524 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 9.3 t80 -72.59 -28.78 63.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.049 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.518 HD23 ' O ' ' A' ' 85' ' ' TYR . 2.2 mm? -78.32 -45.28 23.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.018 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.411 ' HG2' ' HA ' ' A' ' 87' ' ' ASP . 0.1 OUTLIER -75.46 -36.72 60.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.621 -179.288 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 53.7 m -75.52 -11.04 59.94 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.418 ' NE2' HD11 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -76.71 113.96 14.94 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.843 0.354 . . . . 0.0 111.07 -179.868 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -51.34 101.36 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.336 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.8 pp . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.243 -0.884 . . . . 0.0 111.361 -179.946 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.649 HD22 ' C ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 120.903 0.383 . . . . 0.0 111.325 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.1 mp -85.01 103.62 14.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.778 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -43.16 85.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.945 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -59.54 -45.43 91.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.847 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -63.62 -46.68 84.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.225 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.638 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -63.56 -30.69 71.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.603 179.537 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -67.26 -45.35 76.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.437 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.833 HD21 ' HG3' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -62.72 -42.19 99.53 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 109.506 -0.554 . . . . 0.0 109.506 178.73 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.638 HD12 ' HA ' ' A' ' 8' ' ' LYS . 25.4 mt -62.35 -54.06 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.037 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.2 t -57.47 -33.24 67.76 Favored 'General case' 0 C--N 1.333 -0.144 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 -179.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.12 -42.63 75.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.782 0.325 . . . . 0.0 110.861 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.61 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.91 -40.06 74.58 Favored Glycine 0 C--O 1.225 -0.459 0 N-CA-C 109.158 -1.577 . . . . 0.0 109.158 177.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.902 HD21 ' HG2' ' A' ' 73' ' ' GLU . 1.7 mm? -54.81 -59.17 5.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.592 -1.304 . . . . 0.0 109.448 178.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.413 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -60.23 -30.93 69.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.543 179.685 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 0.6 OUTLIER -67.69 -46.36 72.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.241 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.599 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -69.74 -49.36 53.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.718 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 74.6 p -55.4 -50.44 69.75 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.133 0.492 . . . . 0.0 110.151 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.452 ' O ' ' HB2' ' A' ' 24' ' ' GLN . 47.2 t -62.56 -34.55 65.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.271 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.966 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 12.2 tp -62.56 -46.22 89.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.469 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.997 HD13 ' HB2' ' A' ' 81' ' ' PHE . 6.0 mt -63.91 -37.24 86.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.095 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.69 -17.44 44.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.824 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 5.2 mt-30 -106.99 -3.4 20.14 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -46.9 160.09 0.09 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 19.7 t -104.69 128.41 58.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 118.81 0.732 . . . . 0.0 111.73 -179.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -102.23 121.27 41.93 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.838 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.439 ' O ' ' HA ' ' A' ' 31' ' ' LEU . 3.3 p30 -149.33 145.74 27.18 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.495 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.406 ' HA ' ' N ' ' A' ' 31' ' ' LEU . 1.7 p30 -86.75 151.37 52.46 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.294 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -77.99 17.09 8.95 Favored 'Cis proline' 0 C--N 1.347 0.489 0 C-N-CA 123.536 -1.443 . . . . 0.0 113.281 0.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.906 HD13 ' CE1' ' A' ' 92' ' ' HIS . 0.7 OUTLIER 72.55 144.67 0.07 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.364 0.602 . . . . 0.0 111.94 179.213 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.447 HG21 ' HB3' ' A' ' 36' ' ' ASP . 11.4 p -77.1 157.54 5.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.04 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.445 ' N ' HG22 ' A' ' 32' ' ' VAL . 3.0 p -79.51 171.01 15.74 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.263 0.554 . . . . 0.0 111.909 -178.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.893 ' O ' HG23 ' A' ' 38' ' ' VAL . 1.5 mt-10 -68.76 -34.45 75.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.112 -178.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -34.73 78.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.9 0.381 . . . . 0.0 110.716 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.886 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.3 OUTLIER -71.8 -42.15 67.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.115 179.454 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.671 ' O ' HG23 ' A' ' 41' ' ' VAL . 12.5 tpp -65.15 -43.43 91.83 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 34' ' ' GLU . 93.9 t -55.89 -48.0 79.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.305 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -46.62 88.23 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.864 0.364 . . . . 0.0 110.364 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.886 HG23 ' O ' ' A' ' 36' ' ' ASP . 23.7 t -56.75 -45.47 82.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.835 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.671 HG23 ' O ' ' A' ' 37' ' ' MET . 39.5 t -66.73 -44.98 89.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.789 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -51.16 71.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.415 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.2 OUTLIER -60.05 -43.48 95.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.156 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.966 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 7.9 m0 -60.78 -41.06 94.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.337 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.9 ttp -68.0 -43.98 77.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.327 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -70.87 -39.81 72.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.941 0.401 . . . . 0.0 110.014 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.445 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -59.38 -41.5 89.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.574 179.091 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.453 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 3.9 m-85 -65.01 -48.09 75.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.775 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.858 HD11 ' HB2' ' A' ' 71' ' ' ARG . 0.7 OUTLIER -54.2 -55.0 16.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.082 -179.395 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.457 ' N ' HG22 ' A' ' 49' ' ' ILE . 70.9 m-80 -68.97 -36.74 78.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.806 0.336 . . . . 0.0 111.085 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.445 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 7.0 t80 -63.07 -42.04 99.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.126 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.645 ' O ' HG22 ' A' ' 56' ' ' VAL . 27.8 m-85 -75.47 -33.68 60.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.54 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.674 ' HA ' HD11 ' A' ' 67' ' ' LEU . 2.8 ttm-85 -58.37 -31.59 67.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.12 0.486 . . . . 0.0 110.581 179.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -101.03 -9.81 21.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.196 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.833 ' HG3' HD21 ' A' ' 10' ' ' LEU . 12.4 tp-100 -97.54 -3.29 40.04 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.662 ' HB ' ' CG ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -78.81 173.58 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.469 179.564 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.457 HG22 ' H ' ' A' ' 58' ' ' GLY . 5.0 m -139.79 171.09 14.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.034 179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.457 ' H ' HG22 ' A' ' 57' ' ' THR . . . 88.15 -150.4 22.07 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.171 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.411 ' O ' ' HD2' ' A' ' 63' ' ' ARG . 0.4 OUTLIER -77.9 162.95 65.67 Favored Pre-proline 0 C--N 1.334 -0.103 0 CA-C-O 120.829 0.347 . . . . 0.0 111.286 -179.693 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.431 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 40.2 Cg_endo -67.26 -26.62 41.71 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.914 2.409 . . . . 0.0 113.319 -179.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -70.82 -44.18 67.05 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.067 0.461 . . . . 0.0 110.891 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -67.38 -38.25 84.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.959 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.662 ' CG ' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -57.64 -51.3 70.07 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.39 0.614 . . . . 0.0 109.427 178.896 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -58.06 -41.64 83.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.649 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 9.5 tttt -61.59 -49.69 75.62 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.474 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.1 -33.66 67.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.22 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.674 HD11 ' HA ' ' A' ' 53' ' ' ARG . 5.5 mp -69.99 -36.55 75.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.32 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 1.9 pp0? -72.89 -44.74 60.92 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.218 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -63.03 -38.59 91.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.351 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.447 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -63.39 -49.11 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.792 179.521 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.858 ' HB2' HD11 ' A' ' 49' ' ' ILE . 2.7 tpt180 -55.19 -44.85 75.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.523 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.26 -34.52 76.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.24 0.543 . . . . 0.0 109.846 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.902 ' HG2' HD21 ' A' ' 15' ' ' LEU . 1.2 tp10 -60.88 -45.3 95.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.068 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.9 mt -67.61 -45.08 76.46 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.972 0.415 . . . . 0.0 110.366 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -39.8 63.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.011 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.464 HG22 ' O ' ' A' ' 73' ' ' GLU . 10.3 t -80.55 -36.15 33.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.041 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.448 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 2.4 mt -71.24 -29.88 65.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.898 -179.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.84 -30.08 63.73 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.566 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.5 t30 -57.73 -50.09 90.06 Favored Pre-proline 0 CA--C 1.532 0.28 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.566 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 40.5 Cg_endo -67.69 -42.01 7.44 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.278 1.985 . . . . 0.0 112.828 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.997 ' HB2' HD13 ' A' ' 22' ' ' LEU . 1.8 t80 -63.76 -52.59 59.72 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.155 0.502 . . . . 0.0 110.036 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.403 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 24.1 mt -56.59 -29.28 61.9 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.429 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.445 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.03 -48.33 63.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.847 0.356 . . . . 0.0 110.519 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.2 mmtm -57.17 -40.78 77.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.551 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.46 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -77.61 -33.15 53.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.721 -179.544 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.445 ' HG2' ' HA ' ' A' ' 83' ' ' ALA . 1.0 OUTLIER -68.33 -40.52 81.57 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.016 179.409 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.59 -37.21 68.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.862 179.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.513 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 9.1 t80 -71.92 -29.22 64.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.14 178.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.746 HD23 ' HG2' ' A' ' 34' ' ' GLU . 0.5 OUTLIER -78.64 -45.52 21.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.422 178.1 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -67.24 -32.3 73.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.8 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 75.1 m -77.64 -2.42 35.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.514 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.906 ' CE1' HD13 ' A' ' 31' ' ' LEU . 46.0 m170 -83.69 105.2 14.41 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.861 0.362 . . . . 0.0 110.945 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.67 103.04 0.06 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.051 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 25.5 mt . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.93 -179.99 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.598 ' O ' ' HB3' ' A' ' 6' ' ' ALA . 28.1 mt . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.668 0.27 . . . . 0.0 111.296 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.641 ' N ' HD13 ' A' ' 4' ' ' LEU . 0.1 OUTLIER -54.02 -48.55 70.37 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.827 0.346 . . . . 0.0 111.058 -179.962 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -22.37 32.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.688 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.598 ' HB3' ' O ' ' A' ' 3' ' ' LEU . . . -63.88 -44.2 93.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.52 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -63.59 -57.64 9.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.977 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -57.57 -34.21 68.98 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.852 179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -62.32 -44.12 97.23 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.443 . . . . 0.0 109.831 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.44 ' HA ' HD22 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -60.63 -43.32 97.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.716 178.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.808 HD11 ' HB1' ' A' ' 66' ' ' ALA . 40.5 mm -62.04 -54.58 32.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.01 -32.91 22.77 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.668 0.271 . . . . 0.0 111.222 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.13 -42.06 69.7 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.596 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.554 ' N ' ' OH ' ' A' ' 52' ' ' TYR . . . -71.07 -28.42 70.39 Favored Glycine 0 C--O 1.231 -0.085 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 177.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.594 HD23 HG22 ' A' ' 11' ' ' ILE . 1.7 mm? -70.52 -61.17 1.87 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.511 -0.845 . . . . 0.0 109.092 178.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.619 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -57.21 -30.9 64.94 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.896 -179.954 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.419 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 1.5 mm-40 -68.24 -46.09 71.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.413 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.574 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -73.82 -47.38 39.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.351 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.52 -51.42 67.07 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.953 0.406 . . . . 0.0 110.484 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 16' ' ' LYS . 58.0 t -66.41 -36.77 78.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.642 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.992 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 0.8 OUTLIER -59.52 -46.18 89.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.76 0.314 . . . . 0.0 111.137 -179.818 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.918 HD13 ' HB2' ' A' ' 81' ' ' PHE . 15.0 mt -70.51 -34.92 72.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.987 0.422 . . . . 0.0 110.396 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -82.7 -18.43 40.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.154 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.489 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 2.1 mp0 -117.44 12.37 14.18 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -51.58 162.92 0.33 Allowed 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 177.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 24.2 t -112.57 136.41 48.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 119.854 1.206 . . . . 0.0 110.876 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.478 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.2 m-85 -112.15 95.26 5.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.776 0.798 . . . . 0.0 110.545 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -137.84 157.46 46.38 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.311 -1.313 . . . . 0.0 111.002 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.662 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 1.2 p30 -101.33 147.0 33.18 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.774 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.662 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 19.7 Cg_endo -58.08 142.61 23.76 Favored 'Cis proline' 0 C--N 1.351 0.704 0 C-N-CA 123.857 -1.31 . . . . 0.0 112.53 -0.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.461 HD22 ' CE2' ' A' ' 88' ' ' PHE . 7.6 mt -82.19 132.12 35.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.058 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.545 HG22 ' HB3' ' A' ' 36' ' ' ASP . 14.9 p -74.83 143.91 12.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.829 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.7 p -79.97 172.79 13.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.957 0.408 . . . . 0.0 111.537 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.899 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -71.07 -29.66 65.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.423 -179.515 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.44 -38.27 81.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.223 0.535 . . . . 0.0 110.267 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.888 ' O ' HG23 ' A' ' 40' ' ' VAL . 4.9 t70 -71.83 -36.92 70.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.501 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.743 ' O ' HG23 ' A' ' 41' ' ' VAL . 1.8 tpt -67.05 -45.71 76.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.482 178.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.899 HG23 ' O ' ' A' ' 34' ' ' GLU . 89.7 t -55.78 -46.54 79.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.302 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -46.3 88.94 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.847 0.356 . . . . 0.0 110.16 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.888 HG23 ' O ' ' A' ' 36' ' ' ASP . 35.0 t -58.41 -44.05 87.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.696 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.743 HG23 ' O ' ' A' ' 37' ' ' MET . 24.9 t -65.48 -48.47 82.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.611 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.58 -46.52 77.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.464 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.632 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -64.53 -40.89 96.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.542 179.56 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.992 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 5.8 m0 -60.83 -43.99 97.53 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.948 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.7 mtm -66.96 -48.91 67.1 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.781 -178.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -71.13 -28.1 64.04 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.632 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.76 -48.13 82.07 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.125 179.262 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -71.69 -38.48 70.59 Favored 'General case' 0 C--O 1.227 -0.09 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.114 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.687 HD11 ' HB2' ' A' ' 71' ' ' ARG . 10.8 mm -57.41 -55.34 21.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.799 0.333 . . . . 0.0 111.274 -179.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -67.33 -39.71 85.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.186 0.517 . . . . 0.0 110.386 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.499 ' HB3' ' O ' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -61.07 -38.2 85.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.485 179.599 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.554 ' OH ' ' N ' ' A' ' 14' ' ' GLY . 3.2 m-85 -76.1 -36.74 58.79 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -178.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.832 ' HA ' HD11 ' A' ' 67' ' ' LEU . 6.6 ttm180 -59.96 -26.53 66.07 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.419 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 54' ' ' GLN . 6.9 tt0 -93.79 -13.51 27.26 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.492 ' HG3' ' CE1' ' A' ' 51' ' ' TYR . 18.7 mm-40 -103.09 1.94 34.03 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -178.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.538 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -85.85 168.96 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.288 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.1 p -142.58 171.34 14.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.837 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 87.39 -153.54 25.31 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.373 -0.918 . . . . 0.0 112.774 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.5 144.34 86.31 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-O 120.683 0.277 . . . . 0.0 110.891 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.472 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 19.1 Cg_endo -59.12 -24.6 74.47 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.79 2.327 . . . . 0.0 112.725 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.07 -38.32 75.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.938 0.399 . . . . 0.0 110.673 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -68.65 -47.0 67.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.284 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.538 ' HA ' HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -63.51 -50.7 68.58 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.114 0.483 . . . . 0.0 110.066 179.743 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.39 -37.36 67.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.085 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.69 -50.14 59.19 Favored 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.467 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.808 ' HB1' HD11 ' A' ' 11' ' ' ILE . . . -59.57 -35.0 73.43 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.22 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.832 HD11 ' HA ' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -69.44 -40.49 77.17 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.116 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -72.08 -41.62 67.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.079 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.504 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 7.9 mt-10 -66.78 -37.67 85.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.721 HD23 ' HA ' ' A' ' 67' ' ' LEU . 0.4 OUTLIER -67.04 -44.48 80.11 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.282 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.687 ' HB2' HD11 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -55.21 -49.01 73.05 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.828 179.509 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.504 ' HG2' ' HA ' ' A' ' 69' ' ' GLU . 8.4 pt20 -63.31 -31.83 73.09 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.53 ' O ' HG22 ' A' ' 76' ' ' THR . 5.8 tp10 -63.83 -42.45 97.63 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.719 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.494 HD22 ' CD2' ' A' ' 18' ' ' PHE . 5.2 mt -68.02 -45.38 74.18 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 121.134 0.492 . . . . 0.0 110.062 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.76 -37.14 65.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.004 -179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 73' ' ' GLU . 11.0 t -80.86 -32.8 34.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.704 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.419 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 1.5 mt -75.07 -29.64 60.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.895 -179.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.17 -32.1 61.18 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.552 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 3.1 m120 -52.12 -50.2 80.22 Favored Pre-proline 0 C--N 1.33 -0.256 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 49.0 Cg_endo -69.92 -34.98 13.0 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.353 2.036 . . . . 0.0 112.76 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.918 ' HB2' HD13 ' A' ' 22' ' ' LEU . 1.8 t80 -65.31 -53.67 40.49 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.1 mt -58.81 -28.08 65.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.449 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.483 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.71 -41.3 75.55 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.105 0.479 . . . . 0.0 110.376 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -42.52 92.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.587 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.545 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.4 OUTLIER -74.62 -37.92 62.7 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.927 -179.38 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.483 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 12.1 ptm180 -65.32 -37.31 86.73 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.5 -34.91 67.99 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.461 ' CE2' HD22 ' A' ' 31' ' ' LEU . 45.6 t80 -72.05 -28.29 63.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.765 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.707 HD13 ' CE1' ' A' ' 92' ' ' HIS . 1.1 mm? -75.05 -45.8 39.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.408 179.142 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -75.93 -34.49 59.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.624 -179.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 66.6 m -82.47 -17.0 46.76 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.707 ' CE1' HD13 ' A' ' 89' ' ' LEU . 0.7 OUTLIER -89.77 126.09 35.54 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.023 179.136 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -51.67 86.68 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.425 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.439 ' N ' ' O ' ' A' ' 92' ' ' HIS . 3.4 mt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.954 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.803 0.335 . . . . 0.0 111.087 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.5 mt -143.0 101.11 3.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.073 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -22.71 57.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.701 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -63.38 -46.77 84.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.958 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -63.27 -53.24 55.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.452 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.637 ' HA ' HD12 ' A' ' 11' ' ' ILE . 1.6 tttm -62.5 -30.9 71.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.988 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -67.78 -40.38 83.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.842 0.353 . . . . 0.0 110.347 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.637 HD11 ' NE2' ' A' ' 55' ' ' GLN . 3.5 tp -65.22 -44.28 88.82 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.637 HD12 ' HA ' ' A' ' 8' ' ' LYS . 16.8 mt -61.95 -54.5 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.523 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 23.1 t -55.61 -39.74 71.16 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.21 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.11 -40.11 80.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.23 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.506 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -70.66 -30.86 68.13 Favored Glycine 0 N--CA 1.451 -0.308 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.523 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.7 mm? -64.9 -61.33 2.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.102 -1.049 . . . . 0.0 110.608 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.623 ' O ' HG23 ' A' ' 20' ' ' VAL . 6.3 mttm -62.17 -36.59 82.33 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -59.72 -50.67 72.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.97 178.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.626 ' CE2' HD13 ' A' ' 74' ' ' LEU . 1.0 OUTLIER -67.26 -50.54 60.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.101 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 t -57.81 -51.63 68.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.874 0.369 . . . . 0.0 111.089 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 16' ' ' LYS . 58.9 t -64.75 -32.57 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.769 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.928 HD11 ' CH2' ' A' ' 44' ' ' TRP . 0.2 OUTLIER -70.36 -46.26 64.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.103 179.73 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.952 HD22 ' CD2' ' A' ' 81' ' ' PHE . 13.8 mt -62.1 -37.58 85.62 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.441 -179.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.63 -38.79 23.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.727 0.298 . . . . 0.0 111.603 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.732 ' O ' ' N ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -106.46 21.31 17.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.776 -179.208 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.488 ' N ' ' O ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -46.27 60.96 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.416 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.732 ' N ' ' O ' ' A' ' 24' ' ' GLN . 11.6 p 27.96 102.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 123.42 0.688 . . . . 0.0 112.517 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.52 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 14.2 m-30 -108.21 95.86 5.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.515 0.674 . . . . 0.0 111.185 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 66.4 m-20 -137.03 149.12 47.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.786 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.538 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 4.5 p-10 -95.95 136.79 21.97 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.426 179.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 32.4 Cg_endo -63.82 156.74 71.08 Favored 'Cis proline' 0 C--N 1.35 0.625 0 C-N-CA 123.825 -1.323 . . . . 0.0 112.415 0.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.489 HD11 ' CE2' ' A' ' 88' ' ' PHE . 7.1 mt -102.0 147.09 26.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.363 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.505 HG12 ' OH ' ' A' ' 85' ' ' TYR . 7.2 p -76.7 148.59 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.9 m -79.22 169.69 17.75 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.164 0.506 . . . . 0.0 111.535 -177.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.88 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.4 OUTLIER -67.53 -36.61 81.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.03 -179.142 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -36.53 84.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.152 0.501 . . . . 0.0 110.353 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.922 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.6 OUTLIER -74.2 -37.62 63.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.337 178.505 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.873 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.2 OUTLIER -64.35 -47.23 80.14 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.716 178.758 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 34' ' ' GLU . 60.2 t -57.61 -45.48 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.803 178.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.0 m -57.96 -47.9 81.55 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.822 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.922 HG23 ' O ' ' A' ' 36' ' ' ASP . 40.8 t -57.65 -40.24 74.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.808 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.873 HG23 ' O ' ' A' ' 37' ' ' MET . 5.1 t -63.02 -48.05 89.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.528 179.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.495 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 0.3 OUTLIER -54.77 -45.58 74.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.735 179.726 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.554 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -72.15 -36.38 69.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.746 179.648 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.928 ' CH2' HD11 ' A' ' 21' ' ' LEU . 1.9 m0 -64.46 -45.33 87.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.321 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.941 ' CB ' HD12 ' A' ' 74' ' ' LEU . 1.9 ptm -71.5 -36.14 71.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.495 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -71.94 -40.81 68.47 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.554 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.5 -46.19 91.04 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.793 179.099 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.474 ' CD1' ' CZ ' ' A' ' 52' ' ' TYR . 3.4 m-85 -60.3 -47.67 85.04 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.644 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.4 mm -54.19 -55.34 14.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.357 -179.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.52 ' HA ' ' HG2' ' A' ' 53' ' ' ARG . 43.9 t30 -69.8 -33.39 72.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.029 0.442 . . . . 0.0 111.171 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.481 ' CZ ' ' NE2' ' A' ' 55' ' ' GLN . 17.0 t80 -68.19 -40.95 82.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.782 -179.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.506 ' OH ' ' HA3' ' A' ' 14' ' ' GLY . 21.9 m-85 -75.68 -36.56 60.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.348 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.756 ' HB3' HD21 ' A' ' 67' ' ' LEU . 7.1 ptp85 -59.88 -24.64 64.43 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.498 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -92.52 -23.64 19.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.519 -179.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.637 ' NE2' HD11 ' A' ' 10' ' ' LEU . 29.0 mt-30 -93.71 34.21 1.22 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.036 0.446 . . . . 0.0 111.666 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.542 HG11 ' HG3' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -112.97 164.76 8.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.093 -179.665 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.6 m -138.45 171.74 13.92 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 81.56 -163.4 44.35 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 119.869 -1.158 . . . . 0.0 112.866 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -64.55 160.55 51.29 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-O 120.872 0.368 . . . . 0.0 111.36 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.427 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 43.7 Cg_endo -67.62 -26.96 39.17 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.92 2.413 . . . . 0.0 112.984 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.415 ' HA ' ' OD2' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -55.62 -41.4 73.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.183 0.516 . . . . 0.0 111.287 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -63.37 -46.66 85.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.029 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.542 ' HG3' HG11 ' A' ' 56' ' ' VAL . 2.3 mpt_? -56.09 -51.63 67.19 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.166 0.508 . . . . 0.0 110.26 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.415 ' OD2' ' HA ' ' A' ' 61' ' ' GLN . 0.1 OUTLIER -55.58 -41.6 73.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.256 -178.901 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -49.72 76.45 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.98 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -57.2 -36.93 71.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.946 -179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.756 HD21 ' HB3' ' A' ' 53' ' ' ARG . 7.8 mp -70.47 -33.26 71.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.8 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.409 ' CG ' ' O ' ' A' ' 64' ' ' ASP . 1.2 mt-30 -73.55 -48.54 32.17 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.941 0.401 . . . . 0.0 110.192 179.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.27 -33.19 74.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.423 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.538 ' O ' HD23 ' A' ' 74' ' ' LEU . 0.8 OUTLIER -69.39 -48.27 61.64 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.749 -0.38 . . . . 0.0 109.978 179.195 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -55.23 -40.83 71.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.926 0.393 . . . . 0.0 110.392 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.0 -46.41 43.85 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.408 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 34.2 mm-40 -60.61 -34.1 73.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.033 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.941 HD12 ' CB ' ' A' ' 45' ' ' MET . 0.1 OUTLIER -68.86 -47.02 66.99 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.284 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -53.72 -37.23 63.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.877 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.543 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 1.0 OUTLIER -81.14 -50.74 9.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.048 179.546 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.572 HD22 HD12 ' A' ' 22' ' ' LEU . 3.9 mt -60.18 -39.54 86.85 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 -178.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.24 -46.95 81.55 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -177.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.507 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.5 OUTLIER -50.98 -50.48 74.6 Favored Pre-proline 0 CA--C 1.535 0.393 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.264 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.543 ' CD ' ' O ' ' A' ' 76' ' ' THR . 50.5 Cg_endo -69.86 -24.09 29.59 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 122.313 2.009 . . . . 0.0 112.946 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.952 ' CD2' HD22 ' A' ' 22' ' ' LEU . 1.3 t80 -67.84 -53.48 26.55 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.769 0.319 . . . . 0.0 110.89 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.12 -29.31 60.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.523 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.12 -47.51 57.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.39 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.2 mmmm -56.98 -38.99 73.8 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.496 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.505 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.6 OUTLIER -73.85 -33.89 64.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.54 179.779 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -42.47 99.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.133 0.492 . . . . 0.0 109.757 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.88 -32.4 65.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.181 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.52 ' CE2' ' CD2' ' A' ' 27' ' ' PHE . 22.0 t80 -73.55 -28.72 62.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.956 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 85' ' ' TYR . 4.8 mt -76.59 -44.82 32.84 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.56 -34.41 75.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.957 -1.019 . . . . 0.0 111.45 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 77.5 p -101.37 0.58 37.28 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -178.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.492 ' HB2' ' O ' ' A' ' 88' ' ' PHE . 24.2 t60 -51.46 114.53 1.26 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.637 0.732 . . . . 0.0 111.919 -177.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -51.1 159.14 0.65 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 114.494 -1.23 . . . . 0.0 112.969 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.594 HD12 ' OXT' ' A' ' 94' ' ' LEU . 2.6 pp . . . . . 0 C--O 1.248 1.01 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.118 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 tp . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.714 0.292 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.516 HD12 ' HB2' ' A' ' 7' ' ' ASN . 0.5 OUTLIER -146.91 93.37 2.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.919 0.39 . . . . 0.0 111.264 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.413 ' O ' ' HB3' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -58.66 -20.72 50.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.923 179.393 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.62 -45.69 73.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.191 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.516 ' HB2' HD12 ' A' ' 4' ' ' LEU . 5.7 t-20 -62.4 -54.87 33.92 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.123 0.487 . . . . 0.0 110.356 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt -60.03 -29.3 68.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.048 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.413 ' HB3' ' O ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -70.26 -39.23 75.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.704 -0.226 . . . . 0.0 110.396 -179.946 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.506 HD22 ' O ' ' A' ' 55' ' ' GLN . 0.6 OUTLIER -65.67 -44.77 85.24 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 179.062 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.57 HD12 ' HB1' ' A' ' 66' ' ' ALA . 42.4 mm -62.06 -54.45 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.05 179.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.7 t -61.42 -34.29 75.13 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 120.815 0.34 . . . . 0.0 110.276 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.411 ' HB2' ' O ' ' A' ' 9' ' ' ASP . . . -59.11 -40.33 85.04 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.933 -179.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.481 ' CA ' ' OH ' ' A' ' 52' ' ' TYR . . . -68.96 -43.64 72.16 Favored Glycine 0 N--CA 1.454 -0.154 0 N-CA-C 109.307 -1.517 . . . . 0.0 109.307 177.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.515 HD11 ' HG2' ' A' ' 73' ' ' GLU . 1.7 mm? -54.27 -58.62 6.69 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.081 -1.06 . . . . 0.0 109.613 178.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.554 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -60.84 -29.36 69.46 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.038 178.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.439 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 5.5 mt-10 -65.27 -48.9 71.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.977 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.506 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -65.49 -50.14 66.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.654 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -51.65 68.59 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.066 0.46 . . . . 0.0 110.787 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.554 HG23 ' O ' ' A' ' 16' ' ' LYS . 70.6 t -62.34 -28.26 44.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.477 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.98 HD11 ' CH2' ' A' ' 44' ' ' TRP . 1.5 tp -66.71 -46.45 75.51 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.818 HD13 ' HB2' ' A' ' 81' ' ' PHE . 2.1 mt -62.42 -38.1 88.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.776 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -24.88 34.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.31 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.454 ' C ' ' H ' ' A' ' 26' ' ' VAL . 3.1 tt0 -113.11 21.16 15.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.7 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.588 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -70.25 34.59 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.295 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.588 ' O ' ' O ' ' A' ' 25' ' ' GLN . 16.5 t 31.93 115.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 178.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.498 ' HB3' ' CZ ' ' A' ' 88' ' ' PHE . 2.7 m-85 -107.23 128.37 54.36 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.741 0.781 . . . . 0.0 110.682 178.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.783 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 9.2 p-10 -149.45 152.77 36.22 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.837 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.522 ' HB3' ' CE1' ' A' ' 92' ' ' HIS . 3.0 p30 -131.53 117.24 16.48 Favored Pre-proline 0 C--N 1.314 -0.966 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.998 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.72 172.96 56.57 Favored 'Cis proline' 0 C--N 1.348 0.542 0 C-N-CA 123.457 -1.476 . . . . 0.0 112.386 0.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.783 ' HB3' ' O ' ' A' ' 28' ' ' ASN . 2.7 pt? -157.71 -156.0 0.55 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.452 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.452 ' N ' ' HG ' ' A' ' 31' ' ' LEU . 13.7 p -74.49 138.92 20.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.411 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.8 p -80.31 175.37 10.71 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.016 0.436 . . . . 0.0 111.574 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.885 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -66.76 -38.89 87.51 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.117 -179.152 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.68 -36.07 82.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.287 0.565 . . . . 0.0 110.303 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.93 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -74.03 -34.81 64.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.427 178.77 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.791 ' O ' HG23 ' A' ' 41' ' ' VAL . 19.7 tpp -67.46 -47.31 70.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.629 178.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.885 HG23 ' O ' ' A' ' 34' ' ' GLU . 49.0 t -56.64 -47.66 81.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.423 179.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -58.07 -46.06 86.07 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.93 HG23 ' O ' ' A' ' 36' ' ' ASP . 48.2 t -59.13 -37.67 69.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.78 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 37' ' ' MET . 34.7 t -65.44 -49.13 80.17 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.781 0.324 . . . . 0.0 110.78 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.456 ' HA ' ' SD ' ' A' ' 45' ' ' MET . 1.3 tt0 -55.37 -46.55 76.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.105 0.479 . . . . 0.0 110.777 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.625 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -71.74 -36.32 70.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.996 179.613 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.98 ' CH2' HD11 ' A' ' 21' ' ' LEU . 4.1 m0 -65.03 -45.82 83.87 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.523 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.828 ' CB ' HD12 ' A' ' 74' ' ' LEU . 1.6 ptm -71.41 -37.49 71.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.527 -179.399 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -71.34 -39.28 71.44 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.625 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.05 -45.88 92.97 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.058 179.194 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -61.64 -47.99 82.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.199 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.469 HG22 ' N ' ' A' ' 50' ' ' ASN . 0.6 OUTLIER -54.48 -55.28 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.217 -179.458 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.469 ' N ' HG22 ' A' ' 49' ' ' ILE . 30.0 t30 -69.46 -37.3 77.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.008 0.432 . . . . 0.0 111.09 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.461 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 21.2 t80 -61.26 -43.8 98.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.864 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.552 ' O ' HG22 ' A' ' 56' ' ' VAL . 23.5 m-85 -75.51 -29.29 59.46 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.244 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.795 ' CB ' HD21 ' A' ' 67' ' ' LEU . 10.4 ttm180 -57.55 -27.55 62.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.949 0.404 . . . . 0.0 110.172 178.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -101.81 -15.4 16.93 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.506 ' O ' HD22 ' A' ' 10' ' ' LEU . 26.5 mm-40 -97.53 46.21 1.03 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.821 0.343 . . . . 0.0 111.63 -179.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.833 HG21 ' HB3' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -125.3 164.62 24.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.299 -179.616 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 18.7 p -134.46 171.47 14.26 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 79.23 -149.95 33.03 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.016 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.98 156.12 92.46 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.822 0.344 . . . . 0.0 111.273 -179.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.517 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 42.8 Cg_endo -67.67 -25.94 39.79 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.73 2.287 . . . . 0.0 112.681 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.12 -41.68 93.16 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.894 0.378 . . . . 0.0 111.359 -179.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -61.1 -46.78 89.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.498 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.833 ' HB3' HG21 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.48 -50.81 68.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.207 0.527 . . . . 0.0 109.684 179.471 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -55.26 -41.4 72.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.693 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.462 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 14.5 ttmt -63.05 -49.91 72.7 Favored 'General case' 0 C--N 1.334 -0.104 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.656 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.57 ' HB1' HD12 ' A' ' 11' ' ' ILE . . . -57.23 -34.46 68.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.848 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.795 HD21 ' CB ' ' A' ' 53' ' ' ARG . 7.4 mp -71.81 -39.53 69.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.825 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 7.2 pt20 -73.2 -47.0 47.21 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.813 0.34 . . . . 0.0 110.403 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.49 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -62.32 -39.72 93.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.127 179.614 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.734 ' O ' HD23 ' A' ' 74' ' ' LEU . 7.0 mt -61.84 -48.89 78.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.197 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -55.45 -44.68 76.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.813 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.58 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -70.53 -38.26 74.21 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.142 0.496 . . . . 0.0 110.342 179.469 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.58 ' N ' ' HG3' ' A' ' 72' ' ' GLN . 1.7 tp10 -65.21 -32.78 74.62 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.24 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.828 HD12 ' CB ' ' A' ' 45' ' ' MET . 0.1 OUTLIER -68.44 -45.91 71.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.515 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -53.7 -39.71 65.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.988 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.481 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 7.3 t -80.74 -50.58 9.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.85 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.498 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.9 mt -58.07 -35.14 70.94 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -179.116 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.44 -38.37 71.33 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.534 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 3.6 m120 -51.75 -50.28 78.51 Favored Pre-proline 0 C--N 1.328 -0.359 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 55.2 Cg_endo -70.08 -28.67 23.42 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.49 2.127 . . . . 0.0 113.18 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.818 ' HB2' HD13 ' A' ' 22' ' ' LEU . 2.3 t80 -65.51 -52.45 52.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.89 0.376 . . . . 0.0 111.4 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 55.0 mt -58.94 -28.64 66.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.841 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.25 -48.0 53.67 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.758 0.313 . . . . 0.0 110.434 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -56.93 -40.5 76.49 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.094 0.473 . . . . 0.0 110.115 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.445 ' CZ ' ' HE2' ' A' ' 37' ' ' MET . 0.1 OUTLIER -70.95 -33.35 70.39 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.29 179.447 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 52.2 mmt-85 -61.52 -41.03 96.71 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.508 ' HA ' ' HG2' ' A' ' 90' ' ' LYS . 1.1 m-20 -72.71 -31.11 64.76 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.352 178.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.507 ' CZ ' ' NE2' ' A' ' 92' ' ' HIS . 43.9 t80 -75.96 -28.75 58.03 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.213 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.455 HD13 ' HA ' ' A' ' 89' ' ' LEU . 2.1 mm? -78.09 -45.28 23.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.564 179.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.508 ' HG2' ' HA ' ' A' ' 87' ' ' ASP . 15.2 ptpt -70.15 -34.12 72.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.08 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.441 ' HG ' ' HA ' ' A' ' 88' ' ' PHE . 87.3 p -78.96 -26.9 43.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.209 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.522 ' CE1' ' HB3' ' A' ' 29' ' ' ASP . 0.0 OUTLIER -63.29 110.67 1.97 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.895 0.379 . . . . 0.0 111.095 -179.781 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -52.64 91.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.231 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.8 mt . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.911 179.955 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.711 0.291 . . . . 0.0 111.147 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 mp -85.51 7.57 22.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.47 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.98 -27.62 14.0 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.323 0.582 . . . . 0.0 109.884 178.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.05 -44.42 74.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.786 178.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -61.94 -55.79 25.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.262 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.688 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -57.84 -31.72 66.93 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.038 -179.916 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.4 -43.78 84.85 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.25 -46.36 90.07 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.801 179.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.688 HD12 ' HA ' ' A' ' 8' ' ' LYS . 12.8 mt -60.66 -54.36 36.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.481 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -53.92 -38.6 65.04 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 120.921 0.391 . . . . 0.0 110.435 179.57 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -58.49 -43.65 89.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.979 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.494 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -66.81 -28.05 73.6 Favored Glycine 0 N--CA 1.452 -0.239 0 N-CA-C 110.076 -1.21 . . . . 0.0 110.076 176.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.1 OUTLIER -68.58 -61.48 1.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.475 -0.862 . . . . 0.0 110.617 179.397 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.602 ' O ' HG23 ' A' ' 20' ' ' VAL . 2.6 mmtp -56.78 -35.38 68.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.143 0.497 . . . . 0.0 110.11 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 2.1 tt0 -59.87 -50.72 72.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.663 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE2' HD23 ' A' ' 74' ' ' LEU . 0.2 OUTLIER -73.59 -44.74 56.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.472 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.402 ' HA ' HD12 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -60.11 -51.67 68.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.89 0.376 . . . . 0.0 110.774 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 16' ' ' LYS . 47.6 t -66.91 -33.49 63.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.676 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 1.012 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 1.1 tp -68.44 -45.69 71.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.862 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.645 ' CD1' HD22 ' A' ' 77' ' ' LEU . 2.8 mt -63.15 -42.85 99.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.83 0.347 . . . . 0.0 110.814 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -82.8 -23.78 33.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.82 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.478 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -117.58 21.53 12.94 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -178.727 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.476 ' O ' ' C ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -67.05 42.23 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.321 0.105 . . . . 0.0 111.247 179.891 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.478 ' H ' ' C ' ' A' ' 24' ' ' GLN . 16.8 t -6.79 124.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.112 0.965 . . . . 0.0 113.558 -179.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.511 ' HB3' HD21 ' A' ' 31' ' ' LEU . 17.9 m-85 -79.19 96.5 5.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.722 179.072 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.44 ' O ' ' O ' ' A' ' 30' ' ' PRO . 12.7 p-10 -85.22 136.83 33.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.196 -178.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.607 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 2.1 p-10 -99.71 135.15 20.62 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.223 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.607 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 19.3 Cg_endo -58.43 152.09 38.16 Favored 'Cis proline' 0 C--N 1.353 0.776 0 C-N-CA 124.153 -1.186 . . . . 0.0 112.621 0.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.601 HD22 ' HE2' ' A' ' 88' ' ' PHE . 4.0 mt -86.75 140.66 29.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.416 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.441 HG22 ' HB2' ' A' ' 36' ' ' ASP . 12.8 p -88.31 153.4 3.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.178 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.9 p -79.67 175.53 10.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.102 0.477 . . . . 0.0 111.806 -178.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.926 ' O ' HG23 ' A' ' 38' ' ' VAL . 14.5 pt-20 -70.3 -41.14 73.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.852 -178.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.34 -36.55 84.49 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.19 0.519 . . . . 0.0 110.496 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.847 ' O ' HG23 ' A' ' 40' ' ' VAL . 2.4 m-20 -73.49 -35.82 65.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.612 178.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.897 ' O ' HG23 ' A' ' 41' ' ' VAL . 2.7 tpt -66.87 -43.12 84.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.503 178.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.926 HG23 ' O ' ' A' ' 34' ' ' GLU . 50.5 t -59.48 -45.68 93.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.264 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -47.14 84.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.114 179.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.847 HG23 ' O ' ' A' ' 36' ' ' ASP . 22.9 t -58.6 -43.45 87.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.563 179.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 37' ' ' MET . 26.1 t -59.2 -48.83 85.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.589 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.55 -42.03 77.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.582 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -58.18 -46.44 85.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.149 179.368 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 1.012 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 28.8 m0 -60.69 -40.63 92.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.969 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.754 ' HG3' HD13 ' A' ' 74' ' ' LEU . 31.5 ttm -64.2 -50.89 66.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.769 -0.65 . . . . 0.0 112.379 -178.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -70.24 -29.31 66.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.002 0.43 . . . . 0.0 110.18 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.472 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.81 -42.33 97.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.122 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.428 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 27.0 m-85 -73.06 -41.74 63.83 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.527 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 19.9 mm -55.7 -55.4 17.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.499 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -69.48 -38.37 77.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.965 0.412 . . . . 0.0 110.968 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.413 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.7 t80 -59.89 -46.2 90.09 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.212 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.522 ' CE2' HD11 ' A' ' 70' ' ' LEU . 23.0 m-85 -75.84 -28.93 58.42 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.811 ' HB2' HD21 ' A' ' 67' ' ' LEU . 11.4 ttm180 -65.22 -28.66 69.52 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.746 -0.381 . . . . 0.0 110.757 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -91.49 -21.78 20.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.092 -178.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -94.17 46.1 1.15 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.657 HG11 ' HG3' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -132.19 -176.13 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.237 0.541 . . . . 0.0 112.0 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.985 ' O ' ' N ' ' A' ' 59' ' ' GLU . 1.5 p -128.49 163.67 24.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.399 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.403 ' O ' ' HD2' ' A' ' 60' ' ' PRO . . . -32.81 50.4 0.0 OUTLIER Glycine 0 N--CA 1.473 1.134 0 N-CA-C 115.003 0.761 . . . . 0.0 115.003 -178.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.985 ' N ' ' O ' ' A' ' 57' ' ' THR . 2.2 mm-40 -110.57 65.11 0.44 Allowed Pre-proline 0 N--CA 1.432 -1.346 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 176.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.403 ' HD2' ' O ' ' A' ' 58' ' ' GLY . 6.4 Cg_endo -51.42 -43.37 50.15 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 121.173 1.248 . . . . 0.0 111.015 -178.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -71.02 -36.3 72.36 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.621 178.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 59' ' ' GLU . 0.1 OUTLIER -79.63 -35.05 40.03 Favored 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 119.781 -0.768 . . . . 0.0 111.996 -179.68 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.657 ' HG3' HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -65.84 -52.5 49.92 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 179.758 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.29 -41.55 84.65 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.976 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.44 -45.79 71.58 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 119.946 -0.702 . . . . 0.0 110.077 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.95 -39.72 75.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.116 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.811 HD21 ' HB2' ' A' ' 53' ' ' ARG . 7.2 mp -69.82 -35.33 74.7 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.024 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.451 ' O ' ' HG2' ' A' ' 71' ' ' ARG . 3.9 mm-40 -70.42 -46.97 62.89 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.192 0.52 . . . . 0.0 109.728 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.1 -27.24 67.91 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.178 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.522 HD11 ' CE2' ' A' ' 52' ' ' TYR . 0.5 OUTLIER -73.36 -50.17 23.38 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.433 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 68' ' ' GLN . 13.9 ptm180 -57.63 -41.56 81.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.304 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -31.36 61.09 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -61.59 -46.77 88.43 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.256 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.754 HD13 ' HG3' ' A' ' 45' ' ' MET . 1.2 mt -67.92 -42.83 80.47 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-O 121.051 0.453 . . . . 0.0 110.182 178.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -52.47 -42.08 63.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.177 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.1 t -81.13 -29.69 34.71 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.815 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.645 HD22 ' CD1' ' A' ' 22' ' ' LEU . 5.9 mt -79.37 -37.86 36.34 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.71 -29.89 59.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.626 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.567 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -51.07 -50.3 76.06 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.885 -178.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.567 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 45.7 Cg_endo -69.4 -31.02 22.98 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.061 1.841 . . . . 0.0 112.39 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.537 ' CD2' HD23 ' A' ' 22' ' ' LEU . 1.1 t80 -69.85 -54.59 12.84 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.602 HD21 HG21 ' A' ' 41' ' ' VAL . 73.7 mt -55.77 -34.45 65.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.146 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.643 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . . . -62.43 -48.28 80.37 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.299 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -44.7 88.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.966 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -71.32 -41.01 70.4 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.643 ' HG2' ' HA ' ' A' ' 83' ' ' ALA . 0.4 OUTLIER -62.75 -36.73 83.97 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.175 -179.71 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.441 ' N ' ' HG3' ' A' ' 86' ' ' ARG . 0.5 OUTLIER -72.82 -36.4 67.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.197 0.522 . . . . 0.0 109.93 178.645 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.601 ' HE2' HD22 ' A' ' 31' ' ' LEU . 18.5 t80 -70.5 -32.86 70.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.687 179.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -78.5 -45.2 22.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.42 0.629 . . . . 0.0 109.622 178.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -31.52 69.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.864 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 85.0 p -96.0 -18.01 20.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.573 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.476 ' CE1' ' CZ ' ' A' ' 88' ' ' PHE . 1.6 t60 -56.0 104.86 0.15 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.936 0.398 . . . . 0.0 111.513 -179.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -63.27 83.49 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.78 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.9 pp . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.855 -179.897 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.457 HD13 ' HA ' ' A' ' 3' ' ' LEU . 2.2 mm? . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.918 0.39 . . . . 0.0 111.233 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 mp -143.47 143.02 31.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.048 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -19.83 55.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.727 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.6 -45.54 85.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.12 -55.65 20.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.301 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.469 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -58.74 -28.18 65.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.894 179.816 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -71.17 -41.13 70.75 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.572 HD21 ' HG3' ' A' ' 55' ' ' GLN . 6.4 tp -62.13 -46.06 90.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.975 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.496 ' CG2' ' N ' ' A' ' 12' ' ' SER . 0.4 OUTLIER -62.99 -53.86 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 C-N-CA 120.506 -0.478 . . . . 0.0 109.743 179.174 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.496 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -55.83 -33.06 64.13 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 120.91 0.386 . . . . 0.0 110.433 179.503 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.01 -41.6 90.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.583 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.498 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.56 -42.44 72.53 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 177.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.477 HD21 ' OE1' ' A' ' 73' ' ' GLU . 3.9 mt -54.52 -59.52 4.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 113.844 -1.178 . . . . 0.0 109.32 178.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.542 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -59.59 -29.42 67.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.739 179.687 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.411 ' N ' ' HG3' ' A' ' 16' ' ' LYS . 7.3 tt0 -68.47 -45.84 71.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.191 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.782 ' CD2' HD23 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -74.3 -48.45 28.31 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.065 -179.825 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 77.7 p -55.69 -49.75 72.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.031 0.444 . . . . 0.0 110.353 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 16' ' ' LYS . 91.3 t -68.24 -33.12 58.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.521 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.581 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 4.5 tp -63.77 -45.9 87.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.798 0.333 . . . . 0.0 110.725 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.664 ' CD1' HD22 ' A' ' 77' ' ' LEU . 4.8 mt -68.5 -36.63 79.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.952 0.406 . . . . 0.0 110.196 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -82.53 -17.54 44.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.505 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.446 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 11.4 mt-30 -111.11 14.25 21.86 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.401 ' HG3' ' CZ ' ' A' ' 81' ' ' PHE . 0.6 OUTLIER -49.47 162.73 0.14 Allowed 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.734 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.52 131.73 58.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 119.491 1.041 . . . . 0.0 111.372 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -105.7 124.72 50.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.939 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.544 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 3.1 m120 -149.53 147.2 27.9 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.739 -179.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.563 ' HA ' HD23 ' A' ' 31' ' ' LEU . 0.7 OUTLIER -116.74 117.32 37.81 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.284 179.057 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.44 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 29.2 Cg_endo -62.75 165.67 39.96 Favored 'Cis proline' 0 C--N 1.351 0.686 0 C-N-CA 123.879 -1.3 . . . . 0.0 112.784 0.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.563 HD23 ' HA ' ' A' ' 29' ' ' ASP . 0.1 OUTLIER -126.64 167.05 16.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.024 179.797 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.2 p -70.41 143.67 14.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.195 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.96 172.14 14.17 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.278 0.561 . . . . 0.0 112.121 -178.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.887 ' O ' HG23 ' A' ' 38' ' ' VAL . 29.3 mt-10 -62.34 -43.78 98.02 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.328 -178.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -34.83 78.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.127 0.489 . . . . 0.0 110.929 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.899 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.2 m-20 -73.99 -36.95 64.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.656 178.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.627 ' O ' HG23 ' A' ' 41' ' ' VAL . 3.5 tpt -66.81 -47.95 70.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.639 178.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 34' ' ' GLU . 44.3 t -55.73 -45.79 79.44 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.236 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -58.12 -46.03 86.27 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.899 HG23 ' O ' ' A' ' 36' ' ' ASP . 46.0 t -57.75 -41.53 79.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.996 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 37' ' ' MET . 21.6 t -70.43 -46.96 68.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.23 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.05 -47.5 80.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.031 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.606 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 3.3 p30 -68.96 -35.05 76.31 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.061 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.581 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 3.9 m0 -60.72 -43.63 97.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.85 178.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.8 mtm -68.5 -45.71 71.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.661 -178.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.46 ' ND2' ' HA ' ' A' ' 43' ' ' ASP . 0.4 OUTLIER -71.58 -32.0 67.57 Favored 'General case' 0 CA--C 1.521 -0.154 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.914 179.707 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.606 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -61.96 -47.01 86.75 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.697 179.072 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.492 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 12.3 m-85 -65.88 -42.68 90.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.934 0.397 . . . . 0.0 110.582 179.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.407 ' HA ' HD13 ' A' ' 49' ' ' ILE . 12.4 mm -55.63 -55.44 17.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.364 -179.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -72.33 -38.64 68.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.123 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.471 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 13.4 t80 -60.71 -46.38 90.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.998 -179.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.623 ' O ' HG22 ' A' ' 56' ' ' VAL . 30.2 m-85 -75.6 -29.75 59.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.938 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.551 ' CB ' HD21 ' A' ' 67' ' ' LEU . 33.2 ttm180 -61.85 -27.95 69.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.826 0.346 . . . . 0.0 110.575 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -97.08 -16.01 20.71 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -178.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.572 ' HG3' HD21 ' A' ' 10' ' ' LEU . 6.0 pt20 -107.01 43.21 1.19 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.735 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -117.15 156.94 18.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.631 0.253 . . . . 0.0 110.364 178.538 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.4 p -131.08 171.46 13.22 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 85.24 -156.78 31.16 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.776 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -68.6 159.96 79.08 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.742 0.306 . . . . 0.0 111.034 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.412 ' HA ' ' HG3' ' A' ' 63' ' ' ARG . 43.3 Cg_endo -67.4 -27.97 39.56 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.641 2.227 . . . . 0.0 112.333 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -42.25 99.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.848 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.45 -46.59 85.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.559 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.735 ' HA ' HG11 ' A' ' 56' ' ' VAL . 7.9 mtt180 -53.74 -51.84 62.06 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.8 -42.15 75.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.563 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.427 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 2.2 tttt -63.75 -31.94 73.28 Favored 'General case' 0 CA--C 1.522 -0.111 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.732 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.69 -40.74 65.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.551 HD21 ' CB ' ' A' ' 53' ' ' ARG . 6.8 mp -71.71 -33.46 68.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.597 -179.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 5.5 pt20 -74.05 -48.97 26.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.868 0.366 . . . . 0.0 110.155 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.411 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 13.6 tt0 -63.11 -33.19 74.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.476 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.7 mt -67.69 -49.33 63.29 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 67.9 ttp85 -55.41 -45.75 76.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.607 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -71.98 -32.78 67.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.202 0.525 . . . . 0.0 109.851 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.477 ' OE1' HD21 ' A' ' 15' ' ' LEU . 15.8 mm-40 -63.49 -46.92 83.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.068 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.782 HD23 ' CD2' ' A' ' 18' ' ' PHE . 0.9 OUTLIER -67.9 -45.25 74.96 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 121.085 0.469 . . . . 0.0 110.396 178.699 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.09 -39.39 63.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.915 -179.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.1 p -80.69 -33.74 35.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.982 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.664 HD22 ' CD1' ' A' ' 22' ' ' LEU . 4.9 mt -73.14 -31.21 64.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.968 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.34 -30.26 61.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -179.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.56 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.6 m-80 -56.4 -50.34 88.24 Favored Pre-proline 0 C--N 1.328 -0.327 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -179.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.56 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 54.1 Cg_endo -69.67 -38.96 7.26 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.415 2.077 . . . . 0.0 112.667 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.519 ' CB ' HD22 ' A' ' 22' ' ' LEU . 6.1 t80 -62.91 -53.47 53.55 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.011 0.434 . . . . 0.0 110.5 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.1 mt -56.02 -30.57 62.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.749 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.522 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -69.0 -43.24 75.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.957 0.408 . . . . 0.0 110.528 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.3 mtmt -62.2 -43.3 99.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.818 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.441 ' O ' HD23 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -77.28 -33.55 55.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.875 -179.388 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.522 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 8.4 ptm180 -67.1 -38.5 85.76 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.75 -36.26 67.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.657 178.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.476 ' CZ ' ' CE1' ' A' ' 92' ' ' HIS . 15.0 t80 -71.55 -29.09 64.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.392 178.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.441 HD23 ' O ' ' A' ' 85' ' ' TYR . 0.7 OUTLIER -78.77 -45.3 21.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.653 178.451 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -71.23 -34.81 71.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.552 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.1 t -84.89 -5.6 59.34 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.476 ' CE1' ' CZ ' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -86.98 113.34 22.66 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.837 0.351 . . . . 0.0 111.253 -179.732 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -121.62 132.6 54.76 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.3 mt . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.001 -179.981 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.445 ' O ' ' HG ' ' A' ' 4' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 120.524 0.202 . . . . 0.0 111.17 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.729 HD12 ' O ' ' A' ' 4' ' ' LEU . 2.7 pp 34.21 36.78 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.015 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.72 -29.21 64.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.024 0.44 . . . . 0.0 110.951 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.07 -47.28 83.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.022 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -62.26 -54.6 38.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.02 0.438 . . . . 0.0 110.27 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.43 -31.21 65.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.512 179.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -65.89 -45.04 83.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.146 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.576 HD11 ' OE1' ' A' ' 55' ' ' GLN . 2.6 tp -59.9 -45.1 93.6 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 179.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.742 HG22 HD13 ' A' ' 15' ' ' LEU . 37.3 mm -60.05 -54.22 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.2 p -51.09 -32.98 24.13 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.817 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.03 -44.9 71.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.407 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.481 ' HA2' ' OE2' ' A' ' 17' ' ' GLU . . . -66.55 -28.14 73.57 Favored Glycine 0 N--CA 1.452 -0.296 0 N-CA-C 110.694 -0.962 . . . . 0.0 110.694 177.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.742 HD13 HG22 ' A' ' 11' ' ' ILE . 2.6 mp -75.45 -60.68 2.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.388 -0.906 . . . . 0.0 110.964 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.791 ' O ' HG23 ' A' ' 20' ' ' VAL . 12.7 ttpp -60.39 -36.81 78.95 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.712 0.291 . . . . 0.0 110.84 -179.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.481 ' OE2' ' HA2' ' A' ' 14' ' ' GLY . 8.1 pt-20 -67.37 -47.73 69.52 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.486 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.449 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 1.3 t80 -65.98 -44.39 85.01 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.205 179.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 71.2 m -56.84 -51.59 68.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.591 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 16' ' ' LYS . 58.7 t -63.42 -29.36 47.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.412 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.969 HD11 ' CH2' ' A' ' 44' ' ' TRP . 19.1 tp -70.26 -45.88 65.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.471 179.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.777 HD22 ' CD2' ' A' ' 81' ' ' PHE . 6.3 mt -65.95 -40.92 91.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.168 -179.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -82.52 -39.13 22.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.614 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.02 21.15 16.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.706 -179.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.659 ' O ' HG23 ' A' ' 26' ' ' VAL . 0.0 OUTLIER -36.06 -53.66 0.78 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.144 -179.855 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.659 HG23 ' O ' ' A' ' 25' ' ' GLN . 47.2 t 121.48 111.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.149 0.979 . . . . 0.0 110.405 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 8.2 m-30 -102.46 125.77 49.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.54 179.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.527 ' O ' ' HA ' ' A' ' 31' ' ' LEU . 1.4 m-80 -149.4 143.53 25.8 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.364 -179.45 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.455 ' HA ' ' N ' ' A' ' 31' ' ' LEU . 5.1 t70 -106.72 135.16 19.57 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.471 179.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -71.98 120.85 5.96 Favored 'Cis proline' 0 C--N 1.352 0.711 0 C-N-CA 123.834 -1.319 . . . . 0.0 112.382 0.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.596 HD13 ' CE1' ' A' ' 92' ' ' HIS . 0.8 OUTLIER -60.33 160.67 8.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.256 -178.973 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.628 HG12 ' OH ' ' A' ' 85' ' ' TYR . 14.1 p -80.45 157.82 4.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.984 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.458 ' N ' HG22 ' A' ' 32' ' ' VAL . 5.9 m -79.18 171.36 15.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.243 0.544 . . . . 0.0 111.687 -178.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.873 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -69.28 -37.5 77.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.943 -178.685 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.65 -32.96 74.6 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.955 0.407 . . . . 0.0 111.031 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.895 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -74.33 -39.51 62.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.985 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.907 ' O ' HG23 ' A' ' 41' ' ' VAL . 4.4 tpp -67.53 -45.17 76.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.881 179.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.873 HG23 ' O ' ' A' ' 34' ' ' GLU . 56.3 t -59.23 -44.35 91.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.611 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.2 m -61.05 -46.68 89.72 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.378 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 36' ' ' ASP . 43.2 t -58.8 -43.77 88.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.874 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.907 HG23 ' O ' ' A' ' 37' ' ' MET . 13.8 t -65.29 -46.25 91.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.848 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.69 -45.22 85.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.565 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.445 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -66.46 -42.31 87.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.49 179.495 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.969 ' CH2' HD11 ' A' ' 21' ' ' LEU . 9.5 m0 -60.87 -38.97 87.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.895 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 42.5 mtm -71.06 -42.24 69.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.246 -178.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -72.01 -40.52 68.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.852 0.358 . . . . 0.0 110.302 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.452 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -63.65 -39.37 94.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.019 179.382 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.43 ' O ' ' CD2' ' A' ' 52' ' ' TYR . 1.6 m-85 -66.47 -48.46 69.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.063 -179.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.496 HG22 ' N ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -57.42 -55.75 19.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.758 -179.532 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.496 ' N ' HG22 ' A' ' 49' ' ' ILE . 33.9 t30 -63.14 -38.68 92.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.932 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.452 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 4.3 t80 -62.85 -45.93 90.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.621 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.528 ' CD1' ' NE2' ' A' ' 55' ' ' GLN . 32.7 m-85 -70.51 -30.39 67.14 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -178.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.589 ' HA ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -61.23 -19.39 61.6 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.019 179.633 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -102.42 -16.69 16.11 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.142 0.794 . . . . 0.0 113.142 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.576 ' OE1' HD11 ' A' ' 10' ' ' LEU . 0.7 OUTLIER -100.18 46.16 0.96 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 120.617 -0.433 . . . . 0.0 112.081 -179.307 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.968 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -120.08 159.72 21.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.961 0.41 . . . . 0.0 111.106 179.396 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.6 p -134.71 171.74 13.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 82.56 -161.71 40.88 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.273 -0.965 . . . . 0.0 112.95 179.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.77 162.72 26.32 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-O 120.816 0.341 . . . . 0.0 111.007 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.56 -32.02 32.16 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.567 2.178 . . . . 0.0 112.557 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.54 -42.53 96.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.008 0.432 . . . . 0.0 111.047 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -62.35 -46.76 87.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.528 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.968 ' HA ' HG11 ' A' ' 56' ' ' VAL . 5.5 mtt180 -53.56 -52.13 60.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.286 0.565 . . . . 0.0 109.492 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -55.42 -42.23 73.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.45 -178.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.442 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 1.0 OUTLIER -61.76 -34.65 76.23 Favored 'General case' 0 CA--C 1.521 -0.137 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.506 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.506 ' HB1' HD11 ' A' ' 11' ' ' ILE . . . -71.29 -43.59 66.83 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.086 179.112 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.589 HD11 ' HA ' ' A' ' 53' ' ' ARG . 1.1 mp -66.08 -38.69 88.9 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.709 -179.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 0.6 OUTLIER -70.01 -44.66 68.85 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.231 179.843 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 0.5 OUTLIER -62.3 -34.28 76.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.405 179.467 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.504 HD11 ' CE2' ' A' ' 52' ' ' TYR . 0.5 OUTLIER -65.1 -49.65 69.16 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.14 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.407 ' HB2' HD11 ' A' ' 49' ' ' ILE . 4.3 ttm-85 -55.28 -48.7 73.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.861 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.434 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.1 OUTLIER -68.68 -31.21 70.16 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.187 0.518 . . . . 0.0 110.092 179.196 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 0.0 OUTLIER -62.17 -45.7 92.26 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.948 179.761 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 7.7 mt -67.61 -44.39 78.18 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.147 0.499 . . . . 0.0 110.29 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -52.25 -43.43 64.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.142 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.47 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 66.6 m -79.95 -50.48 10.36 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.708 0.289 . . . . 0.0 111.246 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 4.4 mt -56.69 -37.94 71.57 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.43 -37.05 77.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -178.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.529 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.1 t30 -51.65 -50.54 76.66 Favored Pre-proline 0 CA--C 1.534 0.335 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 53.2 Cg_endo -69.94 -34.68 13.51 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.583 2.189 . . . . 0.0 113.338 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.777 ' CD2' HD22 ' A' ' 22' ' ' LEU . 1.4 t80 -64.41 -53.79 42.99 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.698 0.285 . . . . 0.0 110.76 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.1 mt -53.94 -29.93 44.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.65 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.09 -44.7 65.16 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.257 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.0 -43.05 81.35 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.586 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.628 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -73.44 -33.33 64.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.942 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -46.09 83.81 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.93 -32.23 70.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.932 178.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.511 ' CE2' ' CD2' ' A' ' 27' ' ' PHE . 5.6 t80 -72.1 -28.76 63.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.448 179.112 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.537 HD23 ' O ' ' A' ' 85' ' ' TYR . 0.3 OUTLIER -78.07 -44.92 24.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.022 179.32 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.78 -38.75 62.08 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.503 -179.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 54.2 m -64.97 -16.24 63.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.997 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.596 ' CE1' HD13 ' A' ' 31' ' ' LEU . 26.8 m170 -76.59 105.38 7.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.913 0.387 . . . . 0.0 111.233 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -54.86 99.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.999 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.49 HD23 ' HB3' ' A' ' 92' ' ' HIS . 3.3 pp . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.913 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.88 0.371 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.546 HD22 ' OE1' ' A' ' 62' ' ' GLU . 18.5 mt -109.66 -27.12 9.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.01 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -24.57 23.67 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.937 0.399 . . . . 0.0 110.672 179.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.09 -43.95 74.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.557 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -65.07 -48.25 74.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.431 179.596 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.564 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -63.65 -28.25 69.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.954 179.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -72.76 -44.35 61.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.863 0.363 . . . . 0.0 110.213 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.782 HD11 ' HG3' ' A' ' 55' ' ' GLN . 5.1 tp -59.86 -49.29 78.29 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.361 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.794 HD11 ' HG3' ' A' ' 73' ' ' GLU . 0.1 OUTLIER -57.25 -49.73 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.042 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.465 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -55.24 -33.02 62.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.757 179.324 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.413 ' O ' ' HG2' ' A' ' 16' ' ' LYS . . . -67.92 -44.13 77.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.378 -179.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.485 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.59 -40.18 77.89 Favored Glycine 0 C--O 1.229 -0.175 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 177.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.654 HD23 HD11 ' A' ' 77' ' ' LEU . 3.3 mt -54.48 -59.21 4.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 113.761 -1.22 . . . . 0.0 109.557 178.671 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.811 ' O ' HG23 ' A' ' 20' ' ' VAL . 11.0 pttm -59.57 -31.02 69.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.418 179.444 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.2 -46.9 75.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.129 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.584 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -64.11 -49.17 73.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.095 -179.817 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 98.0 p -55.17 -51.41 66.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.875 0.369 . . . . 0.0 111.065 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 16' ' ' LYS . 38.1 t -61.42 -40.58 86.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.155 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.66 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 0.4 OUTLIER -64.47 -46.11 84.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.081 -179.589 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.974 HD22 ' CG ' ' A' ' 81' ' ' PHE . 33.0 mt -62.99 -36.54 83.86 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.301 -179.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -82.65 -22.42 34.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.602 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.467 ' C ' ' H ' ' A' ' 26' ' ' VAL . 1.7 mt-30 -117.4 21.86 12.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.668 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.522 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -66.01 37.08 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -179.162 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.522 ' O ' ' O ' ' A' ' 25' ' ' GLN . 18.4 t 31.6 112.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 178.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 88' ' ' PHE . 34.0 m-85 -107.25 96.09 6.17 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.357 0.599 . . . . 0.0 110.627 178.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.406 ' O ' ' O ' ' A' ' 30' ' ' PRO . 0.5 OUTLIER -122.98 152.75 40.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.613 -179.213 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.671 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 4.2 p-10 -106.18 139.81 20.65 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.99 179.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.671 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 13.3 Cg_endo -55.85 163.57 14.48 Favored 'Cis proline' 0 C--N 1.355 0.888 0 C-N-CA 124.315 -1.119 . . . . 0.0 112.513 0.103 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.517 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.9 mp -109.44 150.86 27.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.664 -179.281 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.65 HG12 ' OH ' ' A' ' 85' ' ' TYR . 13.8 p -76.45 148.9 6.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.33 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.4 m -79.77 172.41 13.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.144 0.497 . . . . 0.0 111.503 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.937 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -67.56 -38.95 84.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.732 -179.131 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -66.74 -37.31 84.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.164 0.507 . . . . 0.0 110.344 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.791 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.1 m-20 -68.55 -39.32 81.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.612 178.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.544 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -66.2 -41.66 89.89 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.478 178.742 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.937 HG23 ' O ' ' A' ' 34' ' ' GLU . 96.7 t -55.85 -47.94 78.98 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.915 179.069 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -46.92 85.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.988 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 36' ' ' ASP . 39.1 t -55.63 -52.03 52.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.76 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 37' ' ' MET . 38.9 t -61.03 -42.91 94.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.446 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.41 -50.24 74.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.451 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.487 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -59.18 -46.3 88.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.439 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.66 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 16.0 m0 -60.7 -40.45 92.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.583 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.431 ' HG3' HD13 ' A' ' 74' ' ' LEU . 3.2 ttp -67.74 -42.9 81.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.8 -179.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -73.51 -34.75 65.41 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.487 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.89 -45.22 90.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.763 179.157 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -65.45 -46.5 79.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.273 -179.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.818 HD11 ' HB2' ' A' ' 71' ' ' ARG . 0.6 OUTLIER -58.53 -55.5 22.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.66 -179.772 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.489 ' N ' HG22 ' A' ' 49' ' ' ILE . 18.1 t30 -62.47 -42.21 99.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.781 179.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.505 ' CD1' ' OE1' ' A' ' 55' ' ' GLN . 13.8 t80 -60.13 -48.89 79.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.771 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.633 ' CE2' HD21 ' A' ' 70' ' ' LEU . 5.3 m-85 -64.5 -33.66 76.41 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -179.374 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.621 ' HA ' HD11 ' A' ' 67' ' ' LEU . 5.8 mtm105 -56.37 -26.35 52.62 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.375 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -99.26 -16.15 18.61 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.782 ' HG3' HD11 ' A' ' 10' ' ' LEU . 1.9 pt20 -103.4 38.9 1.68 Allowed 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.671 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -110.56 159.13 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 178.465 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.437 HG22 ' H ' ' A' ' 58' ' ' GLY . 2.0 m -129.58 171.5 12.53 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.437 ' H ' HG22 ' A' ' 57' ' ' THR . . . 87.36 -155.9 27.61 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.893 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.2 160.33 83.01 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.706 0.289 . . . . 0.0 110.829 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.577 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 27.2 Cg_endo -62.23 -32.64 82.41 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.68 2.253 . . . . 0.0 112.718 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -62.47 -43.11 99.61 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.213 0.53 . . . . 0.0 110.871 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.546 ' OE1' HD22 ' A' ' 4' ' ' LEU . 19.3 mm-40 -60.68 -40.9 93.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.016 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.895 ' O ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -58.08 -50.95 71.69 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.686 179.271 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.37 -41.67 72.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.391 -179.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 5.7 tttm -66.52 -49.86 65.12 Favored 'General case' 0 CA--C 1.522 -0.112 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.278 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.42 -37.29 72.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.69 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.895 HD13 ' O ' ' A' ' 63' ' ' ARG . 8.1 mp -66.67 -41.81 87.57 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.093 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.414 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 1.7 pp0? -67.82 -41.7 82.67 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.85 0.357 . . . . 0.0 110.318 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.401 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 0.5 OUTLIER -62.25 -38.61 89.92 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.248 179.691 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.633 HD21 ' CE2' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -61.4 -48.7 80.03 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.011 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.818 ' HB2' HD11 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -55.27 -48.97 73.25 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.088 -179.66 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.6 -32.67 72.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.075 0.464 . . . . 0.0 110.223 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.794 ' HG3' HD11 ' A' ' 11' ' ' ILE . 25.1 mm-40 -60.59 -45.59 93.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.953 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.431 HD13 ' HG3' ' A' ' 45' ' ' MET . 10.1 mt -67.76 -44.44 77.49 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.022 0.439 . . . . 0.0 110.521 178.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -52.64 -42.78 64.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.227 -179.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 13.1 m -78.29 -32.74 49.59 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.023 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.654 HD11 HD23 ' A' ' 15' ' ' LEU . 2.7 mt -72.72 -30.67 64.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.844 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.79 -28.87 60.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.571 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.7 t30 -58.49 -50.17 89.5 Favored Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.822 0.304 . . . . 0.0 111.822 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.571 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 46.7 Cg_endo -69.03 -41.01 5.65 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.462 2.108 . . . . 0.0 113.014 -179.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.974 ' CG ' HD22 ' A' ' 22' ' ' LEU . 5.1 t80 -58.21 -50.18 74.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.033 0.444 . . . . 0.0 110.869 179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.1 mt -54.53 -37.24 65.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.327 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.24 -44.27 79.86 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.771 0.319 . . . . 0.0 110.615 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.83 -40.88 76.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.067 0.46 . . . . 0.0 110.34 179.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.65 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.4 OUTLIER -76.15 -33.36 59.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.632 179.499 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.43 ' HG2' ' N ' ' A' ' 87' ' ' ASP . 0.0 OUTLIER -61.12 -45.92 92.73 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.054 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.43 ' N ' ' HG2' ' A' ' 86' ' ' ARG . 0.4 OUTLIER -71.05 -33.57 70.4 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.071 178.939 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.517 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 16.8 t80 -69.59 -28.81 66.28 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.263 178.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.621 HD23 ' HG3' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -72.44 -44.58 62.2 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 178.23 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.81 -31.07 71.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.907 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 m -60.53 -10.72 5.44 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -176.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -52.45 159.37 1.03 Allowed 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 178.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.519 ' O ' HD12 ' A' ' 94' ' ' LEU . 2.0 mt-10 -123.53 81.98 1.96 Allowed 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 119.154 0.888 . . . . 0.0 111.787 178.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 93' ' ' GLU . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.834 -179.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.619 HD12 ' N ' ' A' ' 7' ' ' ASN . 1.7 pt? . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.726 0.298 . . . . 0.0 111.146 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.715 HD12 ' N ' ' A' ' 5' ' ' LYS . 2.6 pp -132.23 -50.46 0.94 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.057 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.715 ' N ' HD12 ' A' ' 4' ' ' LEU . 2.5 ttpt -77.46 -42.38 36.16 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.733 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -60.74 -45.14 95.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.382 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.619 ' N ' HD12 ' A' ' 3' ' ' LEU . 1.5 t-20 -60.93 -50.28 74.05 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.713 179.62 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.505 ' HG2' ' HA ' ' A' ' 5' ' ' LYS . 0.3 OUTLIER -61.94 -28.3 69.44 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.12 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.404 ' N ' ' HG3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -74.79 -46.17 38.71 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.495 -179.79 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.793 HD11 ' HG3' ' A' ' 55' ' ' GLN . 0.5 OUTLIER -59.57 -49.06 79.22 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.787 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.487 ' CG2' ' N ' ' A' ' 12' ' ' SER . 1.2 tt -56.77 -51.64 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.22 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.487 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 3.5 m -51.12 -33.44 26.49 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.361 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.54 -47.3 55.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.867 0.365 . . . . 0.0 111.085 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -66.93 -27.99 73.62 Favored Glycine 0 C--O 1.229 -0.162 0 N-CA-C 110.169 -1.173 . . . . 0.0 110.169 177.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.722 HD13 HD11 ' A' ' 77' ' ' LEU . 2.3 mm? -71.32 -61.25 1.84 Allowed 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.328 -0.936 . . . . 0.0 110.159 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.779 ' O ' HG23 ' A' ' 20' ' ' VAL . 9.1 tttt -57.74 -36.78 72.54 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.37 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -63.95 -49.61 71.87 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.677 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.537 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -67.52 -42.53 82.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.956 -179.476 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.1 m -55.48 -50.13 70.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.001 0.429 . . . . 0.0 110.942 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.779 HG23 ' O ' ' A' ' 16' ' ' LYS . 24.7 t -66.47 -39.33 83.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.637 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.902 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 2.8 tp -64.27 -46.13 85.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.743 0.306 . . . . 0.0 111.462 -179.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.607 HD23 ' CD2' ' A' ' 81' ' ' PHE . 0.7 OUTLIER -65.87 -42.35 90.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.05 -179.403 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -82.6 -17.96 42.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.911 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.43 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 13.3 tt0 -117.66 21.61 12.86 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -179.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.631 ' O ' HG23 ' A' ' 26' ' ' VAL . 0.6 OUTLIER -49.6 -67.35 0.27 Allowed 'General case' 0 C--N 1.331 -0.23 0 O-C-N 122.388 -0.195 . . . . 0.0 111.151 179.757 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' ' 25' ' ' GLN . 50.2 t 120.57 119.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.161 0.984 . . . . 0.0 110.667 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -105.36 101.15 10.7 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.977 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -125.33 142.08 51.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.892 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.04 154.01 93.4 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.823 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -83.37 25.41 9.16 Favored 'Cis proline' 0 C--N 1.346 0.429 0 C-N-CA 123.345 -1.523 . . . . 0.0 112.949 0.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.432 ' CD2' ' CE2' ' A' ' 88' ' ' PHE . 1.0 OUTLIER 68.79 136.39 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.985 0.421 . . . . 0.0 111.205 179.893 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.552 HG12 ' OH ' ' A' ' 85' ' ' TYR . 5.5 p -80.72 157.25 4.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.634 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.67 171.19 15.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.134 0.492 . . . . 0.0 111.5 -178.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.881 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -71.02 -32.0 68.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.28 -179.302 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.08 -35.98 82.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.013 0.435 . . . . 0.0 110.196 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.884 ' O ' HG23 ' A' ' 40' ' ' VAL . 6.2 t70 -70.7 -42.37 70.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.855 179.003 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.857 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.0 OUTLIER -63.1 -44.79 94.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.815 179.13 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.881 HG23 ' O ' ' A' ' 34' ' ' GLU . 58.3 t -57.11 -47.27 84.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.699 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.402 ' CG2' ' N ' ' A' ' 40' ' ' VAL . 0.5 OUTLIER -63.52 -47.36 81.97 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.48 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 36' ' ' ASP . 41.7 t -59.33 -42.94 88.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.725 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.857 HG23 ' O ' ' A' ' 37' ' ' MET . 54.8 t -66.3 -48.6 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.476 179.513 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.08 -44.67 83.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.349 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.492 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -59.07 -48.42 81.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.435 179.506 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.902 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 32.5 m0 -60.84 -41.12 95.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.462 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.454 ' HG3' HD13 ' A' ' 74' ' ' LEU . 22.5 ttm -67.77 -43.0 80.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.64 -179.245 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -73.22 -33.26 65.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.987 0.422 . . . . 0.0 109.906 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.492 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -62.54 -41.89 99.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.856 179.151 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -70.65 -43.02 70.04 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.707 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.865 HD11 ' HB3' ' A' ' 71' ' ' ARG . 2.2 mm -56.23 -55.1 20.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.966 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.0 m-80 -68.36 -40.14 81.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.01 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.414 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.5 t80 -59.06 -53.66 55.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.722 ' CD1' HD13 ' A' ' 10' ' ' LEU . 23.5 m-85 -68.8 -28.52 66.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.405 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.754 ' HA ' HD21 ' A' ' 67' ' ' LEU . 42.2 ttm-85 -59.72 -28.96 67.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.07 0.462 . . . . 0.0 110.16 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.3 -9.42 19.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.792 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.793 ' HG3' HD11 ' A' ' 10' ' ' LEU . 3.4 tp-100 -95.64 11.96 31.44 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -178.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.88 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -94.89 177.05 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.236 0.541 . . . . 0.0 111.615 -179.813 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 35.0 p -149.53 171.74 16.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.299 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 80.33 -173.98 54.93 Favored Glycine 0 CA--C 1.519 0.296 0 C-N-CA 120.241 -0.98 . . . . 0.0 114.015 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.426 ' O ' ' HD2' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -52.7 152.26 7.04 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.274 -0.463 . . . . 0.0 111.418 -179.172 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.484 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 14.1 Cg_endo -56.82 -33.35 94.34 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.121 2.547 . . . . 0.0 113.3 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.33 -43.17 98.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.134 0.492 . . . . 0.0 110.912 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.53 -46.77 86.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.642 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.88 ' HA ' HG11 ' A' ' 56' ' ' VAL . 0.4 OUTLIER -54.52 -51.88 63.75 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 121.036 0.445 . . . . 0.0 110.045 179.937 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.01 -42.07 75.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.058 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.503 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 25.1 tttm -61.96 -35.07 77.36 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 120.946 0.403 . . . . 0.0 110.989 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.587 ' HB2' HD21 ' A' ' 7' ' ' ASN . . . -70.68 -40.88 72.67 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.611 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.754 HD21 ' HA ' ' A' ' 53' ' ' ARG . 6.7 mp -70.24 -33.01 71.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.634 -179.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.53 ' HA ' ' HG2' ' A' ' 71' ' ' ARG . 12.1 pt20 -74.71 -48.3 26.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.836 0.35 . . . . 0.0 110.169 179.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.444 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 3.9 mm-40 -62.25 -34.03 75.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.491 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.466 ' CD2' ' CD2' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -68.94 -49.31 59.18 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.4 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.865 ' HB3' HD11 ' A' ' 49' ' ' ILE . 0.5 OUTLIER -55.48 -37.9 68.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.406 -179.999 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.54 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 36.8 mt-30 -71.56 -34.27 69.83 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -41.13 98.68 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.523 179.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 71' ' ' ARG . 5.4 mt -67.9 -45.15 75.21 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.22 0.533 . . . . 0.0 109.748 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -52.35 -41.93 63.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.662 -179.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.466 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 1.1 p -77.32 -50.58 12.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.584 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.722 HD11 HD13 ' A' ' 15' ' ' LEU . 4.0 mt -54.56 -37.73 65.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.068 -179.247 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.2 -27.39 59.58 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.57 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.4 t-20 -52.9 -50.29 82.36 Favored Pre-proline 0 CA--C 1.532 0.268 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.57 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 46.9 Cg_endo -68.8 -36.77 13.04 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.381 2.054 . . . . 0.0 112.609 -179.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.607 ' CD2' HD23 ' A' ' 22' ' ' LEU . 3.3 t80 -68.43 -54.42 17.22 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.008 0.433 . . . . 0.0 110.163 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 19.6 mt -57.15 -37.46 72.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.153 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.483 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -67.98 -40.74 83.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.848 0.356 . . . . 0.0 110.764 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 88' ' ' PHE . 0.1 OUTLIER -61.64 -39.63 91.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.038 0.447 . . . . 0.0 110.171 179.5 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.797 ' O ' HD13 ' A' ' 89' ' ' LEU . 1.2 t80 -77.53 -38.04 49.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.931 179.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.483 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 14.4 ptt180 -62.46 -47.95 81.78 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.482 ' HA ' ' HG2' ' A' ' 90' ' ' LYS . 0.4 OUTLIER -63.11 -39.81 95.78 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.264 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.432 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 6.1 t80 -64.56 -28.45 69.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.742 179.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.797 HD13 ' O ' ' A' ' 85' ' ' TYR . 6.1 mp -75.22 -44.83 44.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.899 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.482 ' HG2' ' HA ' ' A' ' 87' ' ' ASP . 1.6 ptpt -67.14 -34.45 77.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.739 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.4 -2.6 0.75 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -60.92 175.71 0.47 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 177.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -115.12 159.46 20.85 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.52 179.663 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.758 0.313 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.94 92.22 3.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.063 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.48 -25.48 25.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.006 0.432 . . . . 0.0 110.761 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.18 -46.31 84.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.691 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 40.0 m-20 -63.43 -53.06 58.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.364 179.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.504 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -61.93 -33.11 73.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.959 179.798 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -64.74 -42.04 95.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.93 0.395 . . . . 0.0 110.08 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.485 HD11 HE21 ' A' ' 55' ' ' GLN . 0.9 OUTLIER -63.14 -44.83 94.46 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.659 178.959 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.504 HD12 ' HA ' ' A' ' 8' ' ' LYS . 37.0 mt -60.52 -54.25 37.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.461 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 79.5 p -52.18 -41.98 63.08 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-O 120.828 0.347 . . . . 0.0 110.646 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.33 -40.91 83.36 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.033 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.459 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -68.62 -27.95 73.48 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 109.996 -1.242 . . . . 0.0 109.996 176.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 0.2 OUTLIER -71.22 -61.63 1.7 Allowed 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 114.478 -0.861 . . . . 0.0 111.166 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.589 ' O ' HG23 ' A' ' 20' ' ' VAL . 6.6 mmtm -59.19 -33.81 71.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.267 0.556 . . . . 0.0 109.951 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -62.69 -50.87 69.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.877 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.516 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -74.34 -41.75 60.55 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.849 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.409 ' HG ' ' HA ' ' A' ' 16' ' ' LYS . 80.2 p -62.27 -51.64 66.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.804 0.335 . . . . 0.0 110.662 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' ' 16' ' ' LYS . 54.2 t -65.86 -35.44 75.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.444 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.859 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 1.9 tp -68.9 -43.62 74.86 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.037 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.891 HD13 ' HB2' ' A' ' 81' ' ' PHE . 1.5 mt -69.41 -31.36 69.67 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.703 0.261 . . . . 0.0 111.703 -179.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -75.71 -28.94 58.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.484 ' C ' ' H ' ' A' ' 26' ' ' VAL . 4.1 mp0 -117.66 -51.53 2.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.324 0.583 . . . . 0.0 111.547 -179.454 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.859 ' HG3' ' O ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER 64.44 -36.18 0.18 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.778 179.074 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.505 HG23 ' C ' ' A' ' 25' ' ' GLN . 4.7 t 80.91 109.62 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.812 0.339 . . . . 0.0 110.359 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.517 ' CZ ' ' CE1' ' A' ' 85' ' ' TYR . 20.7 m-85 -129.63 106.8 8.98 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.754 0.788 . . . . 0.0 111.819 -178.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -113.28 170.3 8.32 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.323 178.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.46 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 0.7 OUTLIER -96.97 135.58 21.97 Favored Pre-proline 0 C--N 1.315 -0.921 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.459 179.567 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.46 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 42.9 Cg_endo -67.34 151.69 84.36 Favored 'Cis proline' 0 C--N 1.351 0.661 0 C-N-CA 123.79 -1.338 . . . . 0.0 112.528 -0.011 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 mt -95.06 142.75 27.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.24 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.596 HG22 ' HB2' ' A' ' 36' ' ' ASP . 13.8 p -78.59 146.51 7.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.239 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 55.1 p -79.73 171.69 14.79 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.077 0.465 . . . . 0.0 112.006 -178.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.6 ' O ' HG23 ' A' ' 38' ' ' VAL . 4.3 tt0 -63.52 -48.09 78.98 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.317 -178.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -59.24 -33.4 70.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.516 0.674 . . . . 0.0 110.117 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.914 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.1 m-20 -73.22 -33.25 65.25 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.055 178.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.544 ' HG3' ' CD2' ' A' ' 85' ' ' TYR . 0.0 OUTLIER -67.43 -47.27 70.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.451 178.27 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 34' ' ' GLU . 38.8 t -55.7 -46.52 79.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.299 179.281 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -44.52 88.18 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.914 HG23 ' O ' ' A' ' 36' ' ' ASP . 45.4 t -57.96 -48.15 84.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.54 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 37' ' ' MET . 43.1 t -59.91 -48.73 86.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.655 179.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.47 ' OE1' HG12 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -55.05 -45.08 75.25 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.324 179.77 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.599 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -66.41 -43.59 85.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.029 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.627 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 8.3 m0 -62.25 -43.31 99.11 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.175 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.495 ' HA ' HD12 ' A' ' 74' ' ' LEU . 16.7 mtm -67.75 -43.62 79.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.044 -178.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -72.65 -34.87 67.57 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.235 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.599 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -65.91 -42.98 89.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.033 179.158 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -67.3 -48.32 67.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.847 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.533 HG22 ' N ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -59.58 -55.42 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.405 -179.484 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.533 ' N ' HG22 ' A' ' 49' ' ' ILE . 11.0 t30 -60.15 -41.16 92.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.967 0.413 . . . . 0.0 110.907 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.498 ' CG ' ' OE1' ' A' ' 55' ' ' GLN . 6.3 t80 -62.33 -50.97 69.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.717 -179.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.459 ' OH ' ' HA3' ' A' ' 14' ' ' GLY . 17.4 m-85 -64.79 -30.78 71.8 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -178.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.691 ' HA ' HD21 ' A' ' 67' ' ' LEU . 2.1 mtt180 -58.97 -21.53 58.75 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 119.923 -0.711 . . . . 0.0 110.447 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -100.7 -18.7 16.39 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.498 ' OE1' ' CG ' ' A' ' 51' ' ' TYR . 2.5 mt-30 -93.6 47.15 1.22 Allowed 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 120.83 -0.348 . . . . 0.0 111.141 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.904 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -128.82 165.84 27.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.312 0.577 . . . . 0.0 112.3 -179.633 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.82 171.74 14.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.204 -0.907 . . . . 0.0 108.867 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 83.7 -170.83 48.58 Favored Glycine 0 CA--C 1.516 0.154 0 C-N-CA 120.202 -0.999 . . . . 0.0 113.018 179.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.23 145.51 73.91 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-O 120.661 0.267 . . . . 0.0 111.067 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.518 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 12.0 Cg_endo -55.03 -19.96 21.84 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.931 2.421 . . . . 0.0 112.794 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.34 -40.75 77.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.798 0.332 . . . . 0.0 110.972 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.36 -47.01 71.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.39 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.904 ' HA ' HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -60.17 -50.75 72.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.462 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -54.58 -41.18 69.57 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.999 -179.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -60.48 -49.74 76.34 Favored 'General case' 0 CA--C 1.523 -0.078 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.113 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.444 ' O ' ' HG2' ' A' ' 69' ' ' GLU . . . -57.2 -39.61 75.76 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.78 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.691 HD21 ' HA ' ' A' ' 53' ' ' ARG . 3.6 mp -68.77 -37.98 79.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.12 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -70.81 -46.45 62.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.904 0.383 . . . . 0.0 110.271 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 66' ' ' ALA . 8.7 pt-20 -62.19 -35.93 80.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.108 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.466 ' HA ' HD22 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -63.33 -49.52 73.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.74 179.404 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.7 ttt-85 -55.46 -46.28 76.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.792 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.413 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -68.11 -38.35 82.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.15 0.5 . . . . 0.0 110.127 179.403 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 3.1 tp10 -64.47 -35.92 82.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.64 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 45' ' ' MET . 0.1 OUTLIER -68.55 -46.31 69.82 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.282 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -52.57 -39.24 61.32 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.956 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.524 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 6.8 t -80.86 -48.61 12.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.811 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.462 ' O ' HD12 ' A' ' 22' ' ' LEU . 2.0 mt -58.18 -40.72 82.22 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.25 75.93 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.537 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.9 m120 -51.03 -50.37 75.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -177.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 55.6 Cg_endo -69.87 -27.7 25.63 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.377 2.051 . . . . 0.0 113.139 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.891 ' HB2' HD13 ' A' ' 22' ' ' LEU . 1.2 t80 -65.49 -53.58 40.52 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.686 0.279 . . . . 0.0 111.123 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 61.5 mt -53.39 -29.88 37.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.762 0.315 . . . . 0.0 110.441 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.89 -42.1 63.95 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -58.39 -43.19 88.43 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.564 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.544 ' CD2' ' HG3' ' A' ' 37' ' ' MET . 0.4 OUTLIER -72.38 -34.83 68.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.474 179.84 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.91 -45.74 89.6 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -71.58 -30.02 65.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.921 178.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -70.34 -29.25 65.9 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.155 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.406 HD13 ' CE1' ' A' ' 92' ' ' HIS . 1.9 mm? -76.2 -44.29 38.5 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.15 -33.62 73.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.499 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.3 p -60.62 -15.44 28.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.97 -178.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.406 ' CE1' HD13 ' A' ' 89' ' ' LEU . 22.4 m80 -52.71 175.33 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.475 ' HB3' HD12 ' A' ' 94' ' ' LEU . 6.8 mm-40 -77.3 144.17 38.29 Favored 'General case' 0 C--N 1.33 -0.242 0 O-C-N 122.132 -0.355 . . . . 0.0 110.89 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.558 HD12 ' N ' ' A' ' 94' ' ' LEU . 5.0 mp . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.861 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.976 0.417 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.4 pp -126.2 13.94 7.78 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.323 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.47 -27.33 51.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.805 0.336 . . . . 0.0 111.0 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.79 -48.27 81.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.435 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -62.81 -52.26 63.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.282 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.471 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -59.43 -28.32 66.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.015 179.732 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -71.55 -45.26 62.81 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.495 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.625 HD12 ' HD1' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -59.84 -46.64 88.61 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.327 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.628 HG13 HD21 ' A' ' 70' ' ' LEU . 3.7 tt -61.74 -53.73 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.828 179.208 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.484 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 8.0 t -57.38 -33.14 67.52 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-O 120.596 0.236 . . . . 0.0 111.478 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.29 78.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.287 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.457 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -71.74 -33.7 63.13 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 177.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.467 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 1.7 mm? -58.51 -61.16 2.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.093 -1.053 . . . . 0.0 109.51 178.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.732 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.4 OUTLIER -57.57 -35.48 70.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.219 0.533 . . . . 0.0 110.068 179.551 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.34 -48.57 80.7 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.536 179.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.527 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -70.57 -47.18 61.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.843 -179.944 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 89.3 p -55.49 -49.12 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.851 0.358 . . . . 0.0 110.709 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.732 HG23 ' O ' ' A' ' 16' ' ' LYS . 47.8 t -68.08 -31.72 53.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.597 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.947 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 6.2 tp -66.23 -45.69 79.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.825 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.754 HD22 ' CG ' ' A' ' 81' ' ' PHE . 8.2 mt -68.68 -38.93 80.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.222 -179.528 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.28 -27.37 32.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.823 0.344 . . . . 0.0 111.109 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.495 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -112.04 21.56 15.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.109 -179.783 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.66 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -66.25 37.25 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -179.199 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.66 ' O ' ' O ' ' A' ' 25' ' ' GLN . 6.1 m 15.24 125.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 179.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.413 ' HB3' ' CE2' ' A' ' 88' ' ' PHE . 17.8 m-85 -114.22 96.06 5.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.319 178.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -146.63 140.92 26.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.346 -179.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.451 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 1.3 p30 -61.1 144.24 91.29 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.863 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.451 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 56.4 Cg_endo -69.96 128.98 13.7 Favored 'Cis proline' 0 C--N 1.351 0.675 0 C-N-CA 123.5 -1.458 . . . . 0.0 112.418 -0.114 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.2 mt -72.56 127.3 32.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.971 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.555 HG12 ' OH ' ' A' ' 85' ' ' TYR . 9.6 p -73.42 142.29 15.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.31 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.0 t -79.86 172.5 13.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.154 0.502 . . . . 0.0 111.618 -178.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.893 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -66.52 -40.64 89.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.918 -179.017 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -66.16 -36.83 84.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.246 0.545 . . . . 0.0 110.246 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.898 ' O ' HG23 ' A' ' 40' ' ' VAL . 8.9 t0 -71.62 -35.47 70.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.485 178.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.823 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.3 OUTLIER -68.37 -44.47 75.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.59 178.594 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 34' ' ' GLU . 60.9 t -56.25 -47.44 80.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.244 179.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -59.35 -46.74 87.79 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.049 179.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.898 HG23 ' O ' ' A' ' 36' ' ' ASP . 42.5 t -58.59 -44.59 89.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.532 179.466 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.823 HG23 ' O ' ' A' ' 37' ' ' MET . 30.9 t -62.98 -48.91 85.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.487 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.96 -44.11 70.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.49 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.474 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -67.63 -39.05 84.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.422 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.947 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 7.3 m0 -62.84 -44.98 94.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 53.2 mtm -67.13 -45.78 76.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.416 -178.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -66.52 -41.72 88.38 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.436 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.474 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.38 -43.35 92.91 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.229 -0.442 . . . . 0.0 109.875 179.177 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.507 ' HB3' ' CE2' ' A' ' 52' ' ' TYR . 7.1 m-85 -61.13 -52.0 66.72 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.61 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.521 HD12 ' HA ' ' A' ' 49' ' ' ILE . 0.2 OUTLIER -54.43 -55.17 16.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.228 -179.295 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.501 ' N ' HG22 ' A' ' 49' ' ' ILE . 28.7 t30 -64.74 -35.58 81.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.098 0.475 . . . . 0.0 110.234 179.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.551 ' CE1' ' NE2' ' A' ' 55' ' ' GLN . 6.3 t80 -64.8 -35.06 79.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.986 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.96 ' CD2' HD13 ' A' ' 70' ' ' LEU . 26.0 m-85 -75.78 -35.52 60.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.745 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.552 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.1 OUTLIER -60.65 -29.4 69.25 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.692 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -93.62 -14.8 26.04 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -178.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.551 ' NE2' ' CE1' ' A' ' 51' ' ' TYR . 3.5 mt-30 -104.89 43.72 1.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.564 ' HB ' ' CG ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -127.67 168.24 21.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.873 0.368 . . . . 0.0 111.02 178.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.6 p -139.4 171.25 14.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.825 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.65 -152.88 25.48 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.472 -0.871 . . . . 0.0 112.92 179.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.68 152.75 89.41 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-O 120.848 0.356 . . . . 0.0 111.163 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.515 ' HA ' ' HD3' ' A' ' 63' ' ' ARG . 43.7 Cg_endo -67.74 -22.33 43.58 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.737 2.291 . . . . 0.0 113.053 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -63.4 -42.02 98.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.668 -179.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.38 -39.73 81.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.257 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.564 ' CG ' ' HB ' ' A' ' 56' ' ' VAL . 1.2 mpt_? -59.32 -51.17 71.1 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.249 0.547 . . . . 0.0 109.595 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.97 -41.14 86.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.855 -179.577 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.502 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 9.9 tttp -68.04 -50.11 57.31 Favored 'General case' 0 C--N 1.338 0.092 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.585 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.61 -32.39 70.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.503 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.552 HD11 ' CB ' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -71.71 -40.17 69.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.435 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.534 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 3.0 pt20 -66.62 -36.84 83.56 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.534 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.2 tt0 -69.24 -35.09 75.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.002 179.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.96 HD13 ' CD2' ' A' ' 52' ' ' TYR . 4.0 mt -65.49 -49.27 69.68 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.45 -48.89 73.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.317 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.505 ' HG2' ' HA ' ' A' ' 69' ' ' GLU . 7.7 pt20 -64.14 -36.52 84.3 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 178.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 2.9 tp10 -63.08 -37.22 86.34 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.512 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.444 HD23 ' CE2' ' A' ' 18' ' ' PHE . 23.9 mt -68.16 -45.68 72.83 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 177.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.3 m120 -52.95 -38.46 62.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.863 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.441 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 5.6 t -80.86 -49.3 11.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.508 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.8 mt -56.44 -35.25 67.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.205 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.62 -31.67 62.06 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.558 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 2.2 t-20 -51.65 -50.16 78.81 Favored Pre-proline 0 CA--C 1.533 0.319 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.558 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 55.5 Cg_endo -69.84 -32.33 18.43 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.442 2.095 . . . . 0.0 113.119 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.754 ' CG ' HD22 ' A' ' 22' ' ' LEU . 6.2 t80 -65.89 -53.67 36.6 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.886 0.374 . . . . 0.0 110.914 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.6 mt -56.33 -31.31 63.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.756 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.421 ' O ' ' HG3' ' A' ' 86' ' ' ARG . . . -69.08 -46.18 68.42 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.834 0.35 . . . . 0.0 110.392 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -58.02 -42.47 85.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.698 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.555 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.5 OUTLIER -73.03 -33.55 65.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.0 -179.933 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.51 ' HG3' ' N ' ' A' ' 87' ' ' ASP . 0.0 OUTLIER -63.03 -39.4 94.62 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.935 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.51 ' N ' ' HG3' ' A' ' 86' ' ' ARG . 6.7 m-20 -72.8 -32.44 65.56 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.029 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.418 ' O ' ' CD2' ' A' ' 92' ' ' HIS . 7.7 t80 -71.14 -28.92 64.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.713 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp -78.43 -45.04 23.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.456 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.6 mmtt -76.5 -40.37 50.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.007 -178.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 36.4 m -71.83 -13.03 61.56 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.994 -179.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.418 ' CD2' ' O ' ' A' ' 88' ' ' PHE . 1.5 m-70 -57.97 104.92 0.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.917 0.389 . . . . 0.0 110.675 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.617 ' HB3' HD12 ' A' ' 94' ' ' LEU . 0.4 OUTLIER -50.97 138.36 19.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.432 0.634 . . . . 0.0 112.378 -178.222 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.617 HD12 ' HB3' ' A' ' 93' ' ' GLU . 1.4 mp . . . . . 0 C--O 1.248 1.003 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.97 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.683 HD12 ' HB3' ' A' ' 6' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.439 0 N-CA-C 111.638 0.236 . . . . 0.0 111.638 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.419 ' HG ' ' C ' ' A' ' 3' ' ' LEU . 0.1 OUTLIER 34.41 -79.01 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 179.783 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.587 ' N ' ' O ' ' A' ' 3' ' ' LEU . 0.1 OUTLIER -50.12 -31.02 12.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.588 -178.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.683 ' HB3' HD12 ' A' ' 3' ' ' LEU . . . -58.83 -45.43 90.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.846 0.355 . . . . 0.0 110.703 179.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -64.42 -47.93 77.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.22 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.5 ' O ' HG22 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -61.46 -28.1 69.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.954 179.779 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.87 -45.25 52.11 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.47 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.506 HD11 ' HG3' ' A' ' 55' ' ' GLN . 10.6 tp -61.63 -46.38 90.03 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.106 0.479 . . . . 0.0 109.713 178.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.611 HD11 ' HG3' ' A' ' 69' ' ' GLU . 2.6 tt -61.36 -53.6 46.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.648 179.009 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.492 ' N ' ' CG2' ' A' ' 11' ' ' ILE . 6.6 t -52.12 -33.09 38.33 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.909 0.385 . . . . 0.0 110.554 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -67.79 -41.72 82.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.75 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.533 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -70.88 -35.98 65.56 Favored Glycine 0 C--O 1.23 -0.141 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 177.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mp -59.75 -61.01 2.93 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 113.829 -1.186 . . . . 0.0 109.929 179.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.711 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.3 tptp -59.06 -37.09 76.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.229 0.538 . . . . 0.0 110.253 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 6.7 tp10 -61.3 -46.85 88.58 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.386 179.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.478 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.3 OUTLIER -71.12 -49.32 45.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.1 -179.781 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 91.3 p -55.85 -46.36 78.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.907 0.385 . . . . 0.0 110.419 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.711 HG23 ' O ' ' A' ' 16' ' ' LYS . 63.0 t -68.32 -32.91 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.392 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.66 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 6.6 tp -62.62 -45.98 90.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.793 0.33 . . . . 0.0 110.587 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.911 HD22 ' CG ' ' A' ' 81' ' ' PHE . 9.8 mt -72.95 -30.59 63.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.612 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -82.66 -30.14 29.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.542 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.491 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 1.0 OUTLIER -107.91 9.92 28.61 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.473 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.38 160.22 0.17 Allowed 'General case' 0 C--O 1.232 0.184 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 177.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 11.3 p -112.08 138.14 42.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 119.931 1.241 . . . . 0.0 110.158 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.455 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.4 m-85 -116.13 94.73 4.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.524 0.678 . . . . 0.0 110.591 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -149.64 147.64 28.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.422 -179.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.44 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 3.1 p30 -68.77 144.45 95.99 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.388 179.09 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.44 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 56.1 Cg_endo -70.01 127.13 10.57 Favored 'Cis proline' 0 C--N 1.349 0.578 0 C-N-CA 123.536 -1.443 . . . . 0.0 112.361 0.045 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.55 HD22 ' HE2' ' A' ' 88' ' ' PHE . 18.2 mt -73.58 128.4 35.4 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.817 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.406 HG12 ' OH ' ' A' ' 85' ' ' TYR . 7.2 p -73.15 140.38 17.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.777 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.7 p -80.04 173.77 12.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.107 0.48 . . . . 0.0 111.856 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.907 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -62.81 -44.38 96.32 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.082 -179.106 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.32 -36.89 84.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.124 0.488 . . . . 0.0 110.542 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.911 ' O ' HG23 ' A' ' 40' ' ' VAL . 2.4 m-20 -71.55 -36.49 70.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.343 178.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.449 ' HE1' ' HZ ' ' A' ' 81' ' ' PHE . 5.3 tpt -66.91 -45.0 79.31 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.436 178.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.907 HG23 ' O ' ' A' ' 34' ' ' GLU . 77.8 t -55.6 -45.91 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.16 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.026 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -45.45 91.1 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.049 0.452 . . . . 0.0 109.865 178.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.911 HG23 ' O ' ' A' ' 36' ' ' ASP . 36.7 t -55.64 -47.66 78.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.015 179.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 37' ' ' MET . 39.4 t -68.41 -41.69 83.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.799 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -56.24 -47.17 79.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.975 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.549 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 2.8 p30 -71.56 -34.66 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.246 179.539 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.66 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 2.5 m0 -61.76 -46.61 88.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.418 0.627 . . . . 0.0 110.26 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.474 ' HG2' ' N ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -70.91 -36.6 72.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.125 -178.918 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.474 ' N ' ' HG2' ' A' ' 45' ' ' MET . 5.0 t30 -73.6 -39.83 64.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.959 0.409 . . . . 0.0 109.936 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.549 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.88 -45.76 91.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.728 179.438 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.468 ' CE1' ' CZ ' ' A' ' 47' ' ' PHE . 6.8 m-85 -64.71 -46.23 83.19 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.644 179.753 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.43 HG22 HH12 ' A' ' 53' ' ' ARG . 3.5 mm -55.18 -55.17 17.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.147 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -68.76 -37.69 79.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.955 0.407 . . . . 0.0 110.921 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.446 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 1.7 t80 -61.93 -43.07 99.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.91 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.694 ' O ' HG22 ' A' ' 56' ' ' VAL . 24.0 m-85 -75.66 -30.86 59.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.94 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.651 ' HG3' HD21 ' A' ' 67' ' ' LEU . 27.0 ttm105 -61.57 -30.53 70.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.998 0.428 . . . . 0.0 110.411 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -103.49 -10.97 18.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.397 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.506 ' HG3' HD11 ' A' ' 10' ' ' LEU . 9.5 tp-100 -96.33 21.85 8.53 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.729 HG11 ' HA ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -102.12 174.06 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.138 0.494 . . . . 0.0 111.638 -179.599 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.0 p -143.8 171.43 14.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.433 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 83.66 -151.74 28.15 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.302 -0.951 . . . . 0.0 113.08 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.458 ' O ' ' HD3' ' A' ' 63' ' ' ARG . 13.8 mm-40 -75.15 159.45 82.5 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-O 120.726 0.298 . . . . 0.0 111.158 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.435 ' HA ' ' HG2' ' A' ' 63' ' ' ARG . 42.2 Cg_endo -67.6 -29.06 37.22 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.794 2.329 . . . . 0.0 113.861 -178.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.538 ' HG2' ' N ' ' A' ' 62' ' ' GLU . 8.8 pm0 -66.16 -39.13 89.54 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.945 0.403 . . . . 0.0 111.021 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.538 ' N ' ' HG2' ' A' ' 61' ' ' GLN . 18.3 mt-10 -64.17 -46.68 82.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.19 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.729 ' HA ' HG11 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.61 -50.89 68.94 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.222 0.534 . . . . 0.0 109.611 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -55.46 -41.68 73.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.67 -178.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.434 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 8.5 mttt -61.69 -49.93 74.52 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.477 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.425 ' HA ' ' HG2' ' A' ' 69' ' ' GLU . . . -57.4 -35.84 70.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.857 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.651 HD21 ' HG3' ' A' ' 53' ' ' ARG . 6.6 mp -68.78 -37.93 79.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.434 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.435 ' HG3' ' N ' ' A' ' 69' ' ' GLU . 0.0 OUTLIER -70.68 -43.82 68.29 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 179.538 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.611 ' HG3' HD11 ' A' ' 11' ' ' ILE . 9.1 pt-20 -67.65 -26.55 66.28 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.244 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.424 HD22 ' HA ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -69.55 -49.49 53.85 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.443 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.39 -48.84 73.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.785 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.49 -33.88 73.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.164 0.507 . . . . 0.0 109.88 179.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -58.86 -48.23 82.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.656 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.481 HD23 ' N ' ' A' ' 74' ' ' LEU . 4.6 mt -67.45 -42.96 82.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.983 0.42 . . . . 0.0 110.341 178.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -52.29 -40.83 62.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.915 -179.136 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.7 m -81.0 -50.7 9.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.156 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.423 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 0.5 OUTLIER -57.0 -34.57 68.27 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.355 -179.07 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.3 -30.09 60.26 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 -178.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.567 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -51.74 -49.74 81.56 Favored Pre-proline 0 CA--C 1.535 0.389 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.237 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.567 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.5 Cg_endo -69.54 -36.63 11.04 Favored 'Trans proline' 0 C--O 1.235 0.341 0 C-N-CA 122.416 2.077 . . . . 0.0 113.235 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.911 ' CG ' HD22 ' A' ' 22' ' ' LEU . 13.6 t80 -65.04 -53.63 42.86 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.992 0.425 . . . . 0.0 110.415 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 20.1 mt -58.2 -29.43 65.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.588 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -66.41 -48.87 68.68 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 110.155 179.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -57.21 -49.14 76.93 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.567 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.406 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -67.74 -33.41 74.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.693 179.854 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.69 -38.07 88.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.163 0.506 . . . . 0.0 109.654 178.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.84 -31.08 64.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.739 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.581 ' CE1' ' ND1' ' A' ' 92' ' ' HIS . 9.1 t80 -73.23 -37.25 66.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.452 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -79.25 -44.65 21.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.131 178.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 3.0 mmtp -72.23 -36.11 69.02 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -177.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.5 m -110.47 -28.61 8.45 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -178.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.581 ' ND1' ' CE1' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -84.62 157.89 21.04 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.788 0.804 . . . . 0.0 112.671 -177.861 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.438 ' O ' ' CE1' ' A' ' 92' ' ' HIS . 0.1 OUTLIER -113.15 152.93 29.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.34 -1.3 . . . . 0.0 110.612 179.591 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.968 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 3' ' ' LEU . 3.7 mm? . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.771 0.319 . . . . 0.0 111.156 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.55 HD12 ' H ' ' A' ' 7' ' ' ASN . 0.2 OUTLIER -56.98 157.24 5.92 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.773 179.824 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 tttm -77.08 -32.95 57.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.336 -179.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.52 -48.4 80.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.795 0.331 . . . . 0.0 111.114 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.55 ' H ' HD12 ' A' ' 4' ' ' LEU . 0.7 OUTLIER -62.34 -52.9 61.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.933 0.397 . . . . 0.0 110.27 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -59.49 -28.27 66.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.734 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -70.63 -45.15 65.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.598 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.82 HD11 ' CG ' ' A' ' 55' ' ' GLN . 0.3 OUTLIER -60.07 -46.18 90.44 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.273 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.74 HG22 HD12 ' A' ' 15' ' ' LEU . 41.1 mm -61.82 -54.28 36.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.079 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.0 t -61.31 -33.07 72.99 Favored 'General case' 0 C--O 1.227 -0.113 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.69 -43.93 75.04 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.945 -179.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.695 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -70.85 -42.3 61.05 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 177.255 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.74 HD12 HG22 ' A' ' 11' ' ' ILE . 2.1 mt -54.34 -58.7 6.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 113.813 -1.193 . . . . 0.0 109.745 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.533 ' O ' HG23 ' A' ' 20' ' ' VAL . 48.7 tttm -61.77 -31.97 72.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.139 0.495 . . . . 0.0 109.851 179.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.49 -48.54 80.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.252 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.792 ' CE2' HD23 ' A' ' 74' ' ' LEU . 0.5 OUTLIER -72.82 -50.24 25.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.754 -179.904 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.435 ' HA ' HD12 ' A' ' 22' ' ' LEU . 11.1 m -55.41 -51.31 67.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.987 0.423 . . . . 0.0 110.173 179.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 16' ' ' LYS . 95.6 t -65.03 -32.39 58.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.233 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.601 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 3.7 tp -64.19 -45.92 86.22 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.612 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.559 HD22 ' HB2' ' A' ' 81' ' ' PHE . 1.7 mt -66.65 -36.01 81.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.008 0.432 . . . . 0.0 110.129 179.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -82.59 -18.18 42.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.188 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.405 ' N ' ' O ' ' A' ' 20' ' ' VAL . 7.6 mt-30 -107.48 12.24 28.03 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.502 ' HG3' ' CZ ' ' A' ' 81' ' ' PHE . 1.9 mm-40 -50.14 161.97 0.24 Allowed 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 178.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.5 t -109.23 132.08 58.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 119.107 0.867 . . . . 0.0 111.102 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.412 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 5.4 m-85 -107.37 131.49 54.19 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.71 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.567 ' O ' ' O ' ' A' ' 30' ' ' PRO . 5.2 m-80 -149.62 147.12 27.75 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.74 -179.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.585 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 2.5 p30 -114.3 125.13 29.65 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 114.997 -1.002 . . . . 0.0 109.92 178.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.585 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 14.0 Cg_endo -56.26 167.82 10.0 Favored 'Cis proline' 0 C--N 1.356 0.925 0 C-N-CA 124.483 -1.049 . . . . 0.0 112.677 0.423 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 28' ' ' ASN . 6.4 mt -110.98 148.38 32.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.335 -179.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.423 HG12 ' OH ' ' A' ' 85' ' ' TYR . 10.2 p -73.88 154.23 6.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.84 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.81 170.06 17.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.253 0.549 . . . . 0.0 112.117 -178.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.887 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -68.3 -29.52 68.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.591 -179.2 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -34.06 76.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.077 0.465 . . . . 0.0 110.279 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.882 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.3 OUTLIER -71.7 -40.78 69.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.917 179.232 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.807 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -64.63 -45.59 86.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.754 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 34' ' ' GLU . 48.1 t -55.66 -48.16 78.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.875 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.41 HG22 ' O ' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -62.23 -44.86 95.6 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.228 179.638 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.882 HG23 ' O ' ' A' ' 36' ' ' ASP . 53.4 t -59.05 -43.61 89.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.684 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.807 HG23 ' O ' ' A' ' 37' ' ' MET . 35.6 t -67.08 -48.83 77.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.57 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -50.86 71.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.381 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.51 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.7 OUTLIER -60.14 -41.64 93.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.168 179.316 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.601 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 8.4 m0 -60.75 -43.75 97.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.409 179.372 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.586 ' HG3' HD13 ' A' ' 74' ' ' LEU . 0.4 OUTLIER -61.54 -50.67 71.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.228 -178.954 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -68.32 -36.84 79.9 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.51 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -59.75 -41.15 90.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.783 179.177 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.468 ' CD1' ' CE2' ' A' ' 52' ' ' TYR . 4.8 m-85 -70.78 -48.37 54.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.835 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.451 HD13 ' HA ' ' A' ' 49' ' ' ILE . 4.5 mm -53.86 -55.05 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.302 -179.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -68.65 -34.52 75.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.838 0.352 . . . . 0.0 110.966 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.454 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 3.0 t80 -65.36 -44.34 87.95 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.938 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.716 ' O ' HG22 ' A' ' 56' ' ' VAL . 58.8 m-85 -75.43 -33.39 60.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.59 -179.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.794 ' HA ' HD11 ' A' ' 67' ' ' LEU . 29.7 ttm-85 -61.38 -31.22 71.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.664 0.269 . . . . 0.0 111.476 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -96.2 -9.54 30.24 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.82 ' CG ' HD11 ' A' ' 10' ' ' LEU . 4.0 pt20 -113.48 35.47 4.01 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -178.602 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.716 HG22 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -111.75 156.33 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 177.786 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 26.4 p -122.25 169.84 10.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.82 0.343 . . . . 0.0 110.883 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 91.19 -152.35 21.58 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.505 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.95 163.73 66.19 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 120.765 0.316 . . . . 0.0 110.885 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.44 -27.72 39.58 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.616 2.21 . . . . 0.0 112.547 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -41.91 94.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.96 0.409 . . . . 0.0 110.92 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.77 -46.65 84.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.467 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.469 ' HD3' ' HB ' ' A' ' 56' ' ' VAL . 17.4 mtt85 -55.32 -51.18 67.58 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.255 0.55 . . . . 0.0 109.865 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -55.83 -41.45 74.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.353 -0.839 . . . . 0.0 111.541 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -60.18 -49.9 75.79 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.06 0.457 . . . . 0.0 110.3 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.19 68.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.413 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.794 HD11 ' HA ' ' A' ' 53' ' ' ARG . 4.5 mp -67.5 -39.98 85.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.401 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -70.29 -45.67 65.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.123 0.487 . . . . 0.0 110.012 179.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.435 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 2.7 mt-10 -62.87 -32.93 74.27 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.239 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.691 HD11 ' CE2' ' A' ' 52' ' ' TYR . 0.3 OUTLIER -65.97 -49.32 68.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.148 0.499 . . . . 0.0 109.683 179.247 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.419 ' HA ' HD12 ' A' ' 74' ' ' LEU . 2.3 tmm_? -55.26 -46.18 76.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.728 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.463 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -69.43 -31.89 70.51 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.089 0.471 . . . . 0.0 110.068 179.09 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.463 ' N ' ' HG3' ' A' ' 72' ' ' GLN . 1.0 OUTLIER -61.82 -45.97 91.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.839 179.584 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.792 HD23 ' CE2' ' A' ' 18' ' ' PHE . 1.8 mt -67.36 -44.69 78.39 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 121.157 0.503 . . . . 0.0 110.315 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 26.6 m120 -52.46 -41.2 63.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.855 -179.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.402 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -80.84 -50.56 9.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.037 179.615 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.513 HD22 ' CD1' ' A' ' 22' ' ' LEU . 4.7 mt -56.21 -34.58 66.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.062 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.08 -28.98 61.64 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.569 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 10.6 t30 -53.84 -50.28 84.67 Favored Pre-proline 0 C--N 1.328 -0.333 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 42.1 Cg_endo -68.29 -39.37 10.16 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.474 2.116 . . . . 0.0 113.222 -179.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.559 ' HB2' HD22 ' A' ' 22' ' ' LEU . 5.7 t80 -63.81 -53.53 49.35 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.231 0.538 . . . . 0.0 110.565 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.441 HD21 HG21 ' A' ' 41' ' ' VAL . 88.3 mt -57.57 -31.5 66.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.794 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.477 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -68.3 -45.2 73.66 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.961 0.41 . . . . 0.0 110.772 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -59.62 -41.86 91.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.059 0.457 . . . . 0.0 110.587 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.438 ' O ' ' HG ' ' A' ' 89' ' ' LEU . 0.2 OUTLIER -77.57 -35.71 52.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.691 -179.833 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 22.3 ptt180 -64.17 -39.49 94.12 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.568 -0.453 . . . . 0.0 109.819 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.59 -36.99 68.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.72 178.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.509 ' O ' ' ND1' ' A' ' 92' ' ' HIS . 4.5 t80 -69.6 -29.24 66.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.486 179.098 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 85' ' ' TYR . 6.2 mt -79.17 -45.26 20.29 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.479 178.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.92 -31.34 72.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.151 -178.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -81.93 5.79 17.94 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.509 ' ND1' ' O ' ' A' ' 88' ' ' PHE . 13.1 m80 -72.04 104.06 3.45 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.676 -179.369 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -51.55 115.57 1.68 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.169 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.901 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.476 HD23 ' O ' ' A' ' 4' ' ' LEU . 6.6 tt . . . . . 0 N--CA 1.487 1.39 0 CA-C-O 120.877 0.37 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.476 ' O ' HD23 ' A' ' 3' ' ' LEU . 3.0 mt 58.85 162.92 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.983 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.0 mtmt -60.5 -20.11 59.07 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.017 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.15 -45.75 75.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.052 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.48 -50.61 69.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.273 179.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.61 -33.31 71.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.551 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.77 -44.51 89.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.086 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.493 HD22 ' HA ' ' A' ' 10' ' ' LEU . 0.3 OUTLIER -59.91 -46.54 89.04 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.226 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.747 HD13 ' HE2' ' A' ' 52' ' ' TYR . 35.3 mm -57.79 -53.75 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.821 178.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.508 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 25.1 p -53.0 -42.87 66.02 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.285 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.4 91.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.557 0.218 . . . . 0.0 111.261 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.458 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.91 -28.03 72.38 Favored Glycine 0 CA--C 1.518 0.227 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 177.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.577 HD12 HG22 ' A' ' 11' ' ' ILE . 0.4 OUTLIER -67.35 -61.48 1.89 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.211 -0.994 . . . . 0.0 110.691 179.452 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.761 ' O ' HG23 ' A' ' 20' ' ' VAL . 5.1 mmtt -59.69 -39.18 83.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.308 0.575 . . . . 0.0 109.634 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -59.37 -50.64 73.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.956 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.534 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -69.85 -42.7 73.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.985 -179.756 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.46 -51.06 71.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.991 0.424 . . . . 0.0 110.426 179.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.761 HG23 ' O ' ' A' ' 16' ' ' LYS . 61.1 t -63.29 -33.55 61.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.657 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.953 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 34.9 tp -62.37 -46.14 89.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.826 0.346 . . . . 0.0 110.777 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.832 HD22 ' CG ' ' A' ' 81' ' ' PHE . 36.7 mt -66.25 -41.29 90.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.073 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -80.03 -21.21 43.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.429 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.484 ' C ' ' H ' ' A' ' 26' ' ' VAL . 0.0 OUTLIER -117.55 21.48 12.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.223 -179.691 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.653 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.1 OUTLIER -66.93 36.55 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.118 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.653 ' O ' ' O ' ' A' ' 25' ' ' GLN . 22.4 m 8.45 127.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -107.33 100.47 9.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.211 178.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -113.53 148.48 35.99 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.587 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.479 ' HA ' ' N ' ' A' ' 31' ' ' LEU . 0.6 OUTLIER -92.76 148.14 35.45 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.799 179.821 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.02 116.07 4.11 Favored 'Cis proline' 0 C--N 1.349 0.56 0 C-N-CA 123.39 -1.504 . . . . 0.0 112.263 -0.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.876 HD13 ' CE1' ' A' ' 92' ' ' HIS . 1.0 OUTLIER -38.63 140.12 0.36 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.172 -179.253 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.597 HG12 ' OH ' ' A' ' 85' ' ' TYR . 11.1 p -76.46 152.67 5.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.024 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.0 m -79.97 172.19 14.1 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.204 0.526 . . . . 0.0 111.912 -178.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.91 ' O ' HG23 ' A' ' 38' ' ' VAL . 2.0 mp0 -66.64 -40.74 88.84 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.221 -178.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -37.01 85.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.109 0.48 . . . . 0.0 110.461 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.883 ' O ' HG23 ' A' ' 40' ' ' VAL . 5.0 m-20 -71.91 -35.73 69.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.511 178.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.601 ' O ' HG23 ' A' ' 41' ' ' VAL . 5.5 tpt -67.16 -45.55 76.7 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.506 178.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.91 HG23 ' O ' ' A' ' 34' ' ' GLU . 49.1 t -55.67 -46.74 79.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.232 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -46.87 85.01 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.162 179.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 36' ' ' ASP . 25.5 t -55.83 -51.52 59.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.651 179.367 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 37' ' ' MET . 32.0 t -58.08 -46.42 88.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.544 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.71 -47.09 74.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.466 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.544 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 1.0 OUTLIER -56.83 -48.58 77.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.948 179.833 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.953 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 33.2 m0 -60.76 -42.27 97.12 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.122 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.709 ' HG3' HD13 ' A' ' 74' ' ' LEU . 2.9 ttp -61.86 -50.96 70.17 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.196 -0.457 . . . . 0.0 112.042 -178.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -72.62 -29.6 63.61 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.544 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 1.1 t80 -64.02 -45.47 88.78 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.832 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -69.49 -42.62 74.53 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.306 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 15.1 mm -54.14 -55.29 15.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.197 -179.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.547 ' HA ' ' HG2' ' A' ' 53' ' ' ARG . 13.0 m-80 -66.64 -34.87 78.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.301 0.572 . . . . 0.0 110.171 179.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.479 ' HB2' ' O ' ' A' ' 47' ' ' PHE . 6.6 t80 -62.78 -40.22 96.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.044 179.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.934 ' O ' HG23 ' A' ' 56' ' ' VAL . 5.3 m-85 -75.47 -38.71 59.43 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -178.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.547 ' HG2' ' HA ' ' A' ' 50' ' ' ASN . 4.8 ptp85 -58.75 -31.64 68.52 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.122 -179.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -91.49 -11.38 37.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.591 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.469 ' HG2' ' CE1' ' A' ' 51' ' ' TYR . 2.5 mp0 -96.58 -18.62 19.64 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.134 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.934 HG23 ' O ' ' A' ' 52' ' ' TYR . 14.5 t -68.78 160.39 4.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.08 0.467 . . . . 0.0 111.886 -179.257 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.537 ' N ' HG12 ' A' ' 56' ' ' VAL . 19.4 p -133.88 171.11 14.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.509 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 90.9 -151.08 20.95 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.934 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.401 ' O ' ' HD2' ' A' ' 63' ' ' ARG . 0.5 OUTLIER -78.11 162.91 65.25 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.707 0.289 . . . . 0.0 110.984 -179.853 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -60.98 -28.34 86.14 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.715 2.277 . . . . 0.0 112.761 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -43.29 99.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.131 0.491 . . . . 0.0 110.679 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.23 -46.66 88.99 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.211 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.613 ' HG3' ' HB ' ' A' ' 56' ' ' VAL . 3.7 mpt_? -54.04 -51.19 64.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.05 0.452 . . . . 0.0 110.014 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.43 -41.97 73.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.314 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.421 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 2.2 ttmm -66.66 -32.06 73.14 Favored 'General case' 0 CA--C 1.523 -0.069 0 O-C-N 122.082 -0.386 . . . . 0.0 110.852 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -71.07 -38.33 72.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.464 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.541 HD21 ' HB3' ' A' ' 53' ' ' ARG . 8.9 mp -70.03 -35.05 74.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.588 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 3.3 pp0? -73.81 -46.35 45.81 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.373 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -62.34 -35.65 79.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.522 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.441 HD21 ' CD1' ' A' ' 52' ' ' TYR . 2.1 tp -66.09 -49.02 69.02 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -55.23 -45.65 75.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.796 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.04 -33.53 65.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.041 0.448 . . . . 0.0 110.056 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.447 ' O ' HG22 ' A' ' 76' ' ' THR . 0.4 OUTLIER -60.77 -48.0 83.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.752 179.808 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.709 HD13 ' HG3' ' A' ' 45' ' ' MET . 4.5 mt -67.67 -44.8 76.96 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.931 0.396 . . . . 0.0 110.535 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -52.69 -40.17 62.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.326 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.447 HG22 ' O ' ' A' ' 73' ' ' GLU . 12.1 t -80.87 -34.73 33.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.265 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.431 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 0.6 OUTLIER -72.97 -30.16 63.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.996 -179.276 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.26 -29.4 60.16 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.569 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 15.3 m-20 -54.76 -50.23 87.06 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 48.2 Cg_endo -69.78 -37.87 8.52 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.459 2.106 . . . . 0.0 112.74 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.832 ' CG ' HD22 ' A' ' 22' ' ' LEU . 1.8 t80 -62.75 -53.42 54.58 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 110.415 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 93.2 mt -55.03 -27.64 46.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.283 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -71.47 -45.46 62.49 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.457 179.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 80' ' ' PRO . 7.6 mttt -56.86 -42.94 80.65 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.146 0.498 . . . . 0.0 109.925 179.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.597 ' OH ' HG12 ' A' ' 32' ' ' VAL . 0.2 OUTLIER -75.34 -33.39 61.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.445 179.143 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -44.49 96.28 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.476 ' HA ' ' HG2' ' A' ' 90' ' ' LYS . 1.0 OUTLIER -71.24 -33.55 69.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.007 178.99 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.415 ' CE2' ' CD2' ' A' ' 31' ' ' LEU . 2.9 t80 -71.49 -28.91 64.24 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.017 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.739 HD12 ' OE1' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -78.68 -45.36 21.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.421 179.287 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.476 ' HG2' ' HA ' ' A' ' 87' ' ' ASP . 11.4 pttp -73.83 -37.93 64.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.216 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.4 t -75.22 -11.29 60.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.525 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.876 ' CE1' HD13 ' A' ' 31' ' ' LEU . 2.3 m170 -66.94 105.05 1.51 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.985 0.422 . . . . 0.0 110.98 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -121.62 111.97 17.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.264 178.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mt . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.299 -0.857 . . . . 0.0 110.937 -179.948 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.691 HD12 ' HG ' ' A' ' 4' ' ' LEU . 2.3 pp . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 120.736 0.303 . . . . 0.0 111.252 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.691 ' HG ' HD12 ' A' ' 3' ' ' LEU . 5.5 mt -145.44 101.72 3.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.114 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -55.02 -30.0 58.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.133 0.492 . . . . 0.0 110.534 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -55.22 -44.97 75.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.796 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -64.07 -50.88 66.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.179 179.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -34.48 71.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.568 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -65.15 -42.63 93.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.155 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.967 HD13 ' CE2' ' A' ' 52' ' ' TYR . 0.2 OUTLIER -59.72 -48.22 82.53 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.717 179.324 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.642 HG22 HD13 ' A' ' 15' ' ' LEU . 41.0 mm -59.13 -53.79 43.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.073 178.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 72.3 m -57.21 -33.11 67.18 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.011 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.17 91.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.183 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.508 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -69.75 -41.87 72.7 Favored Glycine 0 CA--C 1.511 -0.201 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 177.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.642 HD13 HG22 ' A' ' 11' ' ' ILE . 0.9 OUTLIER -54.4 -58.9 5.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 113.824 -1.188 . . . . 0.0 109.624 178.824 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.707 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -59.68 -30.92 69.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.373 179.465 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.33 -47.26 74.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.449 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.553 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -71.32 -46.11 61.42 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.71 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 82.9 p -55.51 -51.6 66.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 0.0 110.749 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.707 HG23 ' O ' ' A' ' 16' ' ' LYS . 48.3 t -66.59 -33.27 62.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.967 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.883 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 2.6 tp -66.76 -45.78 77.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.01 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.784 HD22 ' HB2' ' A' ' 81' ' ' PHE . 4.5 mt -68.23 -35.11 77.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.855 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.47 -34.24 31.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.91 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.66 ' O ' HG23 ' A' ' 26' ' ' VAL . 4.8 tt0 -104.8 18.81 21.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.233 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.497 ' O ' HG23 ' A' ' 26' ' ' VAL . 0.0 OUTLIER -39.37 -59.37 1.08 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.762 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 24' ' ' GLN . 42.4 t 98.92 130.19 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.534 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.448 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 3.1 m-85 -122.19 96.18 4.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.979 -179.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -143.71 137.65 28.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.02 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.94 144.13 68.94 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.839 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.84 126.79 12.2 Favored 'Cis proline' 0 C--N 1.349 0.571 0 C-N-CA 123.432 -1.487 . . . . 0.0 112.349 0.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.499 HD22 ' HE2' ' A' ' 88' ' ' PHE . 3.9 mt -70.74 123.79 22.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.114 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 11.6 p -74.55 144.92 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.825 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.86 173.36 12.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.085 0.469 . . . . 0.0 111.734 -178.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.88 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.1 OUTLIER -64.61 -42.81 95.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.141 -179.121 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -66.07 -37.25 85.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.071 0.462 . . . . 0.0 110.756 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.874 ' O ' HG23 ' A' ' 40' ' ' VAL . 3.9 m-20 -71.57 -37.84 71.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.819 179.046 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.765 ' O ' HG23 ' A' ' 41' ' ' VAL . 1.4 tpt -67.91 -45.14 75.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.704 178.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 34' ' ' GLU . 96.1 t -56.41 -44.14 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.448 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -45.57 92.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.924 0.392 . . . . 0.0 110.142 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.874 HG23 ' O ' ' A' ' 36' ' ' ASP . 39.2 t -60.11 -44.23 94.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.533 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.765 HG23 ' O ' ' A' ' 37' ' ' MET . 38.8 t -65.06 -49.11 81.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.62 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.83 -42.94 80.54 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.237 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.402 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -60.26 -41.0 92.33 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.071 0.462 . . . . 0.0 109.774 179.022 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.883 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 10.7 m0 -60.52 -39.35 87.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.249 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.524 ' HA ' HD12 ' A' ' 74' ' ' LEU . 52.0 mtm -68.07 -45.99 72.3 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -178.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -34.35 73.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.03 0.443 . . . . 0.0 110.07 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.449 ' O ' ' CB ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -62.8 -46.19 89.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.098 179.32 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -66.61 -47.39 72.79 Favored 'General case' 0 C--O 1.226 -0.171 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.12 -179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.43 ' HA ' HD12 ' A' ' 49' ' ' ILE . 0.3 OUTLIER -55.31 -55.09 18.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.027 -179.681 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.496 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 8.0 m-80 -66.68 -36.85 83.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.131 0.491 . . . . 0.0 110.727 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.449 ' CB ' ' O ' ' A' ' 47' ' ' PHE . 4.7 t80 -64.65 -39.27 93.4 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.142 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.967 ' CE2' HD13 ' A' ' 10' ' ' LEU . 7.5 m-85 -75.64 -36.75 60.1 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.815 ' HB3' HD21 ' A' ' 67' ' ' LEU . 8.8 ptp180 -58.13 -28.48 64.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.089 0.471 . . . . 0.0 110.8 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -95.49 -8.57 34.91 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.596 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -95.7 -7.83 36.3 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.634 ' HB ' ' HD2' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -85.14 178.29 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.172 0.511 . . . . 0.0 111.715 -178.962 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.0 p -144.91 171.4 14.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.288 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 86.85 -144.85 19.72 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.901 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -79.17 163.69 58.48 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.724 0.297 . . . . 0.0 110.975 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.474 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 45.4 Cg_endo -67.7 -22.74 43.22 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.666 2.244 . . . . 0.0 112.777 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.17 -43.13 92.71 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.938 0.399 . . . . 0.0 110.733 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -60.82 -44.58 96.73 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.081 179.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.634 ' HD2' ' HB ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -55.52 -50.96 68.6 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.225 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -55.28 -41.94 72.95 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.535 -178.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.461 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 0.8 OUTLIER -66.33 -34.41 77.93 Favored 'General case' 0 C--O 1.231 0.101 0 O-C-N 122.103 -0.373 . . . . 0.0 110.955 -179.819 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.487 ' O ' ' HB2' ' A' ' 70' ' ' LEU . . . -69.48 -38.48 77.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.089 0.471 . . . . 0.0 110.032 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.815 HD21 ' HB3' ' A' ' 53' ' ' ARG . 8.1 mp -68.45 -35.94 78.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.395 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 6.0 pt20 -76.08 -48.91 19.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.811 0.338 . . . . 0.0 110.815 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.44 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 1.2 mt-10 -61.98 -41.98 98.63 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.519 -179.543 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.551 HD22 ' CD2' ' A' ' 52' ' ' TYR . 9.5 tp -66.68 -49.1 67.2 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.73 -43.27 76.44 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.431 179.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.4 -41.25 76.67 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.158 0.504 . . . . 0.0 109.65 179.111 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 3.2 tp10 -58.55 -39.41 80.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.601 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.524 HD12 ' HA ' ' A' ' 45' ' ' MET . 1.3 mt -67.98 -45.53 73.91 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.202 0.525 . . . . 0.0 109.813 178.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -52.52 -37.19 56.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.563 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.425 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -80.83 -50.6 9.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.69 179.148 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.474 HD22 ' CD1' ' A' ' 22' ' ' LEU . 3.8 mt -57.81 -35.02 70.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.506 -178.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.16 -30.89 60.86 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.565 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 1.0 OUTLIER -51.52 -49.97 79.48 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.086 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.565 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 51.1 Cg_endo -69.4 -34.1 16.52 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.43 2.087 . . . . 0.0 112.961 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.784 ' HB2' HD22 ' A' ' 22' ' ' LEU . 3.3 t80 -66.97 -53.85 27.64 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.902 0.382 . . . . 0.0 110.22 179.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 90.6 mt -60.6 -27.57 67.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.783 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.529 ' O ' ' HG2' ' A' ' 86' ' ' ARG . . . -70.25 -42.67 71.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.051 0.453 . . . . 0.0 110.465 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.69 -42.9 94.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.299 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -72.66 -42.71 64.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.519 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.529 ' HG2' ' O ' ' A' ' 83' ' ' ALA . 9.1 ptm180 -59.84 -35.4 74.67 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.507 ' HA ' ' HG2' ' A' ' 90' ' ' LYS . 0.1 OUTLIER -72.55 -35.32 67.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.343 178.141 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.499 ' HE2' HD22 ' A' ' 31' ' ' LEU . 15.1 t80 -69.89 -28.55 65.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.004 179.198 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -78.24 -45.52 22.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.141 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.507 ' HG2' ' HA ' ' A' ' 87' ' ' ASP . 17.3 ptpt -72.83 -35.54 67.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.968 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.422 ' N ' ' HG3' ' A' ' 90' ' ' LYS . 68.2 m -86.71 -6.86 58.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.487 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 110.18 0.96 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.903 0.382 . . . . 0.0 110.856 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -121.24 109.96 15.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.354 178.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.145 -0.931 . . . . 0.0 110.906 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.719 ' N ' HD13 ' A' ' 3' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 120.824 0.345 . . . . 0.0 111.353 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.57 -32.15 25.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.126 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.67 -33.2 54.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.94 0.4 . . . . 0.0 110.82 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.617 ' H ' HD23 ' A' ' 3' ' ' LEU . . . -60.37 -45.51 93.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.718 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -64.71 -45.82 84.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.49 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.639 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.6 OUTLIER -64.44 -34.38 78.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.713 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.92 -45.0 83.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.48 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.473 HD21 ' HD1' ' A' ' 52' ' ' TYR . 2.7 tp -60.81 -46.09 91.88 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.211 0.529 . . . . 0.0 109.691 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.639 HD12 ' HA ' ' A' ' 8' ' ' LYS . 12.9 mt -60.48 -53.81 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.962 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.435 ' HA ' ' HB2' ' A' ' 15' ' ' LEU . 4.1 m -55.2 -33.65 63.22 Favored 'General case' 0 C--O 1.227 -0.107 0 CA-C-O 120.912 0.387 . . . . 0.0 110.468 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.06 -41.34 95.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.588 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.494 ' HA3' ' OH ' ' A' ' 52' ' ' TYR . . . -70.39 -40.41 69.09 Favored Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 109.126 -1.59 . . . . 0.0 109.126 176.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.605 HD13 HG22 ' A' ' 11' ' ' ILE . 0.3 OUTLIER -54.64 -60.02 3.92 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.908 -1.146 . . . . 0.0 110.454 179.135 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.665 ' O ' HG23 ' A' ' 20' ' ' VAL . 15.7 tttm -60.8 -34.65 74.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.164 0.507 . . . . 0.0 110.092 179.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.44 -47.76 84.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.214 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.563 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -69.81 -50.31 44.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.852 -179.76 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.612 ' HA ' HD12 ' A' ' 22' ' ' LEU . 61.6 m -55.44 -51.6 66.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.05 0.452 . . . . 0.0 110.836 179.871 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.665 HG23 ' O ' ' A' ' 16' ' ' LYS . 58.3 t -63.66 -33.76 63.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.646 179.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.88 HD21 ' CZ3' ' A' ' 44' ' ' TRP . 1.0 OUTLIER -66.24 -45.95 78.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.647 179.878 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.821 HD22 ' HB2' ' A' ' 81' ' ' PHE . 2.6 mt -61.93 -37.75 85.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.015 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -82.52 -19.29 38.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.034 179.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.432 ' HG3' ' HA ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -109.58 21.28 17.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.425 -179.683 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.801 ' O ' ' O ' ' A' ' 26' ' ' VAL . 0.8 OUTLIER -74.31 29.45 0.08 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.295 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.801 ' O ' ' O ' ' A' ' 25' ' ' GLN . 22.9 t 19.78 133.31 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 N-CA-C 113.815 1.042 . . . . 0.0 113.815 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -114.04 95.85 5.51 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.245 0.545 . . . . 0.0 110.804 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -142.42 142.76 32.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.761 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.583 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 2.4 m-20 -78.2 159.06 76.2 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.867 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.583 ' C ' ' HA ' ' A' ' 29' ' ' ASP . 20.3 Cg_endo -60.65 139.42 24.04 Favored 'Cis proline' 0 C--N 1.352 0.747 0 C-N-CA 123.625 -1.406 . . . . 0.0 112.229 -0.045 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.74 HD13 ' CE1' ' A' ' 92' ' ' HIS . 9.8 mt -76.7 123.69 26.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.116 -179.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.529 HG12 ' OH ' ' A' ' 85' ' ' TYR . 11.5 p -74.82 148.04 8.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.86 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.8 m -79.88 172.46 13.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.073 0.463 . . . . 0.0 111.671 -178.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.846 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -70.32 -29.34 66.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.355 -179.442 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.56 -36.57 78.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.983 0.42 . . . . 0.0 110.436 179.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.895 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.6 OUTLIER -74.11 -36.68 64.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.912 -0.586 . . . . 0.0 109.703 178.938 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.824 ' O ' HG23 ' A' ' 41' ' ' VAL . 2.5 tpt -67.74 -47.29 69.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.615 178.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.846 HG23 ' O ' ' A' ' 34' ' ' GLU . 92.3 t -56.27 -46.06 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.167 179.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.1 m -58.36 -47.15 84.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.137 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.895 HG23 ' O ' ' A' ' 36' ' ' ASP . 42.6 t -59.0 -40.92 81.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.759 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 37' ' ' MET . 20.3 t -67.32 -48.88 76.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.696 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.96 -46.27 78.63 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.529 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -64.39 -41.14 96.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.55 179.542 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.88 ' CZ3' HD21 ' A' ' 21' ' ' LEU . 7.5 m0 -60.83 -42.88 98.6 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.777 179.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.418 ' HA ' HD13 ' A' ' 74' ' ' LEU . 4.6 ttp -68.17 -43.53 78.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.299 -178.44 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -72.42 -34.05 67.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.896 0.379 . . . . 0.0 110.054 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.517 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -63.03 -43.81 97.67 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.116 179.441 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -69.09 -45.72 69.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.334 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.691 HD11 ' HB3' ' A' ' 71' ' ' ARG . 2.0 mm -55.25 -55.7 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.364 -179.273 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.459 ' HA ' ' HD2' ' A' ' 53' ' ' ARG . 20.8 m-80 -65.5 -36.28 83.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.145 0.498 . . . . 0.0 110.731 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.527 ' CD1' ' HG3' ' A' ' 55' ' ' GLN . 0.7 OUTLIER -62.19 -45.61 92.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.517 -179.497 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.546 ' CD2' HD13 ' A' ' 70' ' ' LEU . 17.3 m-85 -76.01 -33.46 59.68 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -178.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 49' ' ' ILE . 0.8 OUTLIER -63.53 -24.99 68.05 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 119.849 -0.741 . . . . 0.0 110.755 -179.697 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -98.79 -16.01 19.07 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.527 ' HG3' ' CD1' ' A' ' 51' ' ' TYR . 7.0 mm-40 -102.09 45.85 0.95 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.563 ' HB ' ' CD ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -125.0 173.54 10.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.173 0.511 . . . . 0.0 111.496 179.353 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.435 ' O ' ' NE ' ' A' ' 63' ' ' ARG . 12.1 p -144.17 171.16 14.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.183 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.49 -155.52 30.97 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.2 -1.0 . . . . 0.0 112.891 179.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.46 ' O ' ' NE ' ' A' ' 63' ' ' ARG . 1.4 mt-10 -67.9 144.76 97.5 Favored Pre-proline 0 C--N 1.333 -0.15 0 CA-C-O 120.755 0.312 . . . . 0.0 111.221 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.473 ' HA ' ' CG ' ' A' ' 63' ' ' ARG . 42.3 Cg_endo -67.45 -25.64 41.46 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.784 2.323 . . . . 0.0 113.084 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.56 -43.89 95.7 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.13 0.49 . . . . 0.0 110.886 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.44 ' HB2' ' NH2' ' A' ' 63' ' ' ARG . 1.8 mt-10 -60.71 -43.36 97.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.045 179.344 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.704 ' O ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -55.26 -51.39 66.79 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.298 0.57 . . . . 0.0 109.605 179.219 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.33 -41.49 72.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.705 -178.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.427 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 0.2 OUTLIER -63.25 -49.78 72.76 Favored 'General case' 0 CA--C 1.523 -0.081 0 C-N-CA 119.941 -0.704 . . . . 0.0 110.328 179.888 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.94 -40.91 90.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.307 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.704 HD13 ' O ' ' A' ' 63' ' ' ARG . 2.4 mp -61.96 -45.89 91.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.459 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' A' ' 71' ' ' ARG . 2.2 pp0? -66.72 -38.23 86.27 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.189 0.519 . . . . 0.0 110.06 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.89 -30.89 71.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.545 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.546 HD13 ' CD2' ' A' ' 52' ' ' TYR . 1.9 mt -71.02 -49.84 40.62 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.141 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.691 ' HB3' HD11 ' A' ' 49' ' ' ILE . 6.7 ptt85 -56.4 -40.26 74.35 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.579 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.455 ' N ' ' HG3' ' A' ' 71' ' ' ARG . 1.1 mt-30 -72.9 -35.91 67.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.227 0.537 . . . . 0.0 109.555 178.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -45.48 94.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.093 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 45' ' ' MET . 11.5 mt -67.87 -45.08 75.53 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.121 0.486 . . . . 0.0 110.329 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -52.7 -38.17 60.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.756 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.402 ' O ' ' CD ' ' A' ' 80' ' ' PRO . 2.6 p -80.86 -50.7 9.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.137 0.494 . . . . 0.0 110.624 179.212 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.408 ' C ' ' HD2' ' A' ' 80' ' ' PRO . 4.4 mt -56.59 -33.01 65.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.148 -179.196 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.19 -31.02 60.83 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.559 ' N ' ' HD2' ' A' ' 80' ' ' PRO . 0.4 OUTLIER -51.85 -50.23 79.14 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.228 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.559 ' HD2' ' N ' ' A' ' 79' ' ' ASN . 52.5 Cg_endo -69.73 -33.98 15.6 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.522 2.148 . . . . 0.0 113.177 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.821 ' HB2' HD22 ' A' ' 22' ' ' LEU . 2.2 t80 -66.15 -53.56 36.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.982 0.42 . . . . 0.0 110.505 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.8 mt -58.31 -29.02 65.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.796 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.9 -47.94 60.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.87 0.367 . . . . 0.0 110.475 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -41.42 84.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.527 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.54 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.3 OUTLIER -76.19 -33.41 59.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.759 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 mmt-85 -67.11 -40.5 86.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.045 0.45 . . . . 0.0 110.098 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.66 -36.89 68.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.926 179.057 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.567 ' O ' ' HB3' ' A' ' 92' ' ' HIS . 26.4 t80 -72.46 -28.78 63.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.676 179.15 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.553 HD23 ' HG3' ' A' ' 34' ' ' GLU . 2.2 mp -71.95 -45.62 60.41 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.64 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -72.83 -31.16 64.59 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.735 -1.12 . . . . 0.0 112.085 -179.273 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.28 -14.15 20.41 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.777 1.028 . . . . 0.0 113.777 -177.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.74 ' CE1' HD13 ' A' ' 31' ' ' LEU . 0.8 OUTLIER -89.7 128.88 36.17 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.566 179.608 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -121.04 142.16 50.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.49 178.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 94' ' ' LEU . 12.2 mt . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.139 -179.883 . . . . . . . . 1 1 . 1 stop_ save_